N-(8,9-dimethoxy-2,3-dihydro-1H-imidazo[1,2-c]quinazolin-5-ylidene)pyridine-3-carboxamide;hydrochloride

C18H18ClN5O3 — CID 162332023

IUPACN-(8,9-dimethoxy-2,3-dihydro-1H-imidazo[1,2-c]quinazolin-5-ylidene)pyridine-3-carboxamide;hydrochloride
SMILESCOc1cc2n/c(=N\C(=O)c3cccnc3)n3c(c2cc1OC)NCC3.Cl
InChIInChI=1S/C18H17N5O3.ClH/c1-25-14-8-12-13(9-15(14)26-2)21-18(23-7-6-20-16(12)23)22-17(24)11-4-3-5-19-10-11;/h3-5,8-10,20H,6-7H2,1-2H3;1H/b22-18+;
InChIKeyFSEUJWQVCFQUSL-MLWJBJAVSA-N
MW387.83 g/mol
LogP2.04
Rot. Bonds3

About N-(8,9-dimethoxy-2,3-dihydro-1H-imidazo[1,2-c]quinazolin-5-ylidene)pyridine-3-carboxamide;hydrochloride

N-(8,9-dimethoxy-2,3-dihydro-1H-imidazo[1,2-c]quinazolin-5-ylidene)pyridine-3-carboxamide;hydrochloride (PubChem CID 162332023) has the molecular formula C18H18ClN5O3 and a molecular weight of 387.83 g/mol. Its IUPAC name is N-(8,9-dimethoxy-2,3-dihydro-1H-imidazo[1,2-c]quinazolin-5-ylidene)pyridine-3-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-(8,9-dimethoxy-2,3-dihydro-1H-imidazo[1,2-c]quinazolin-5-ylidene)pyridine-3-carboxamide;hydrochloride
PubChem CID162332023
Molecular FormulaC18H18ClN5O3
Molecular Weight387.83 g/mol
Exact Mass387.11
IUPAC NameN-(8,9-dimethoxy-2,3-dihydro-1H-imidazo[1,2-c]quinazolin-5-ylidene)pyridine-3-carboxamide;hydrochloride
SMILESCOc1cc2n/c(=N\C(=O)c3cccnc3)n3c(c2cc1OC)NCC3.Cl
InChIInChI=1S/C18H17N5O3.ClH/c1-25-14-8-12-13(9-15(14)26-2)21-18(23-7-6-20-16(12)23)22-17(24)11-4-3-5-19-10-11;/h3-5,8-10,20H,6-7H2,1-2H3;1H/b22-18+;
InChIKeyFSEUJWQVCFQUSL-MLWJBJAVSA-N
XLogP2.04
TPSA90.63 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500387.83
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

N-(8-piperidin-1-yl-2,3-dihydro-1H-imidazo[1,2-c]quinazolin-5-ylidene)pyridine-3-carboxamide;hydrochloride
CID 162315337
2-[[5-(pyridine-3-carbonylimino)-2,3-dihydro-1H-imidazo[1,2-c]quinazolin-8-yl]oxy]acetic acid;hydrochloride
CID 162335180
N-[8-[3-(methanesulfonamido)propoxy]-7-methoxy-2,3-dihydro-1H-imidazo[1,2-c]quinazolin-5-ylidene]pyridine-3-carboxamide
CID 135870810
6-acetamido-N-(7,9-dimethoxy-8-methyl-2,3-dihydro-1H-imidazo[1,2-c]quinazolin-5-ylidene)pyridine-3-carboxamide
CID 135504706
N-[7-methoxy-8-[2-(4-oxohept-5-enoylamino)ethoxy]-2,3-dihydro-1H-imidazo[1,2-c]quinazolin-5-ylidene]pyridine-3-carboxamide
CID 137100727
2-amino-N-(7,8-dimethoxy-2,3-dihydro-1H-imidazo[1,2-c]quinazolin-5-ylidene)pyrimidine-5-carboxamide
CID 138718755
N-[(3R)-3-methyl-2,3-dihydro-1H-imidazo[1,2-c]quinazolin-5-ylidene]pyridine-3-carboxamide;hydrochloride
CID 161471816
methane;N-[(3R)-3-methyl-2,3-dihydro-1H-imidazo[1,2-c]quinazolin-5-ylidene]pyridine-3-carboxamide;hydrochloride
CID 160726894
N-[(2S)-2-butan-2-yl-2,3-dihydro-1H-imidazo[1,2-c]quinazolin-5-ylidene]pyridine-3-carboxamide;methane;hydrochloride
CID 158488766
N-[7-methoxy-8-(3-morpholin-4-ylpropoxy)-2,3-dihydro-1H-imidazo[1,2-c]quinazolin-5-ylidene]pyrazine-2-carboxamide
CID 135871073
N-[7-methoxy-8-[4-oxo-4-[(1R,4R)-3-oxo-2-oxa-5-azabicyclo[2.2.1]heptan-5-yl]butoxy]-2,3-dihydro-1H-imidazo[1,2-c]quinazolin-5-ylidene]pyridine-3-carboxamide;N-[7-methoxy-8-[4-oxo-4-[(1S,4S)-3-oxo-2-oxa-5-azabicyclo[2.2.1]heptan-5-yl]butoxy]-2,3-dihydro-1H-imidazo[1,2-c]quinazolin-5-ylidene]pyridine-3-carboxamide;[7-methoxy-5-(pyridine-3-carbonylimino)-2,3-dihydro-1H-imidazo[1,2-c]quinazolin-8-yl] N-[(3S)-1-methoxy-2-oxoazetidin-3-yl]carbamate;[7-methoxy-5-(pyridine-3-carbonylimino)-2,3-dihydro-1H-imidazo[1,2-c]quinazolin-8-yl] N-[(3R)-1-methoxy-2-oxoazetidin-3-yl]carbamate;[7-methoxy-5-(pyridine-3-carbonylimino)-2,3-dihydro-1H-imidazo[1,2-c]quinazolin-8-yl] (1S,4S)-3-oxo-2-oxa-5-azabicyclo[2.2.1]heptane-5-carboxylate;[7-methoxy-5-(pyridine-3-carbonylimino)-2,3-dihydro-1H-imidazo[1,2-c]quinazolin-8-yl] (1R,4R)-3-oxo-2-oxa-5-azabicyclo[2.2.1]heptane-5-carboxylate
CID 158201491
(4-methoxy-3-methylphenyl)-[4-(pyridine-3-carbonyl)piperazin-1-yl]methanone
CID 110802881

Frequently Asked Questions

What is the IUPAC name of N-(8,9-dimethoxy-2,3-dihydro-1H-imidazo[1,2-c]quinazolin-5-ylidene)pyridine-3-carboxamide;hydrochloride?
The IUPAC name of N-(8,9-dimethoxy-2,3-dihydro-1H-imidazo[1,2-c]quinazolin-5-ylidene)pyridine-3-carboxamide;hydrochloride (CID 162332023) is N-(8,9-dimethoxy-2,3-dihydro-1H-imidazo[1,2-c]quinazolin-5-ylidene)pyridine-3-carboxamide;hydrochloride.
What is the SMILES notation for N-(8,9-dimethoxy-2,3-dihydro-1H-imidazo[1,2-c]quinazolin-5-ylidene)pyridine-3-carboxamide;hydrochloride?
The canonical SMILES for N-(8,9-dimethoxy-2,3-dihydro-1H-imidazo[1,2-c]quinazolin-5-ylidene)pyridine-3-carboxamide;hydrochloride is COc1cc2n/c(=N\C(=O)c3cccnc3)n3c(c2cc1OC)NCC3.Cl.
What is the InChIKey of N-(8,9-dimethoxy-2,3-dihydro-1H-imidazo[1,2-c]quinazolin-5-ylidene)pyridine-3-carboxamide;hydrochloride?
The InChIKey is FSEUJWQVCFQUSL-MLWJBJAVSA-N. The full InChI is InChI=1S/C18H17N5O3.ClH/c1-25-14-8-12-13(9-15(14)26-2)21-18(23-7-6-20-16(12)23)22-17(24)11-4-3-5-19-10-11;/h3-5,8-10,20H,6-7H2,1-2H3;1H/b22-18+;.
What are the key properties of N-(8,9-dimethoxy-2,3-dihydro-1H-imidazo[1,2-c]quinazolin-5-ylidene)pyridine-3-carboxamide;hydrochloride?
N-(8,9-dimethoxy-2,3-dihydro-1H-imidazo[1,2-c]quinazolin-5-ylidene)pyridine-3-carboxamide;hydrochloride has a molecular weight of 387.83 g/mol, XLogP of 2.04, 3 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-(8,9-dimethoxy-2,3-dihydro-1H-imidazo[1,2-c]quinazolin-5-ylidene)pyridine-3-carboxamide;hydrochloride is sourced from PubChem (CID 162332023), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).