N-[3-(3,5-dimethylpiperidin-1-yl)propyl]-4-methylfuro[3,2-c]quinoline-2-carboxamide

C23H29N3O2 — CID 20868564

IUPACN-[3-(3,5-dimethylpiperidin-1-yl)propyl]-4-methylfuro[3,2-c]quinoline-2-carboxamide
SMILESCc1nc2ccccc2c2oc(C(=O)NCCCN3CC(C)CC(C)C3)cc12
InChIInChI=1S/C23H29N3O2/c1-15-11-16(2)14-26(13-15)10-6-9-24-23(27)21-12-19-17(3)25-20-8-5-4-7-18(20)22(19)28-21/h4-5,7-8,12,15-16H,6,9-11,13-14H2,1-3H3,(H,24,27)
InChIKeyQNYWPZZDXOOIGP-UHFFFAOYSA-N
MW379.50 g/mol
LogP4.39
Rot. Bonds5

About N-[3-(3,5-dimethylpiperidin-1-yl)propyl]-4-methylfuro[3,2-c]quinoline-2-carboxamide

N-[3-(3,5-dimethylpiperidin-1-yl)propyl]-4-methylfuro[3,2-c]quinoline-2-carboxamide (PubChem CID 20868564) has the molecular formula C23H29N3O2 and a molecular weight of 379.50 g/mol. Its IUPAC name is N-[3-(3,5-dimethylpiperidin-1-yl)propyl]-4-methylfuro[3,2-c]quinoline-2-carboxamide.

Molecular Properties

Compound NameN-[3-(3,5-dimethylpiperidin-1-yl)propyl]-4-methylfuro[3,2-c]quinoline-2-carboxamide
PubChem CID20868564
Molecular FormulaC23H29N3O2
Molecular Weight379.50 g/mol
Exact Mass379.23
IUPAC NameN-[3-(3,5-dimethylpiperidin-1-yl)propyl]-4-methylfuro[3,2-c]quinoline-2-carboxamide
SMILESCc1nc2ccccc2c2oc(C(=O)NCCCN3CC(C)CC(C)C3)cc12
InChIInChI=1S/C23H29N3O2/c1-15-11-16(2)14-26(13-15)10-6-9-24-23(27)21-12-19-17(3)25-20-8-5-4-7-18(20)22(19)28-21/h4-5,7-8,12,15-16H,6,9-11,13-14H2,1-3H3,(H,24,27)
InChIKeyQNYWPZZDXOOIGP-UHFFFAOYSA-N
XLogP4.39
TPSA58.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500379.50
LogP ≤ 54.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze N-[3-(3,5-dimethylpiperidin-1-yl)propyl]-4-methylfuro[3,2-c]quinoline-2-carboxamide with MolForge

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Related Compounds

2-(5-methylfuran-2-yl)-N-(4-methylphenyl)quinoline-4-carboxamide
CID 868700
Methanone, (1-amino-8,9-dihydro-5,8,8-trimethyl-6H-furo(2,3-b)pyrano(4,3-d)pyridin-2-yl)phenyl-
CID 705157
Methanone, (1-amino-5-ethyl-8,9-dihydro-8,8-dimethyl-6H-furo(2,3-b)pyrano(4,3-d)pyridin-2-yl)phenyl-
CID 1075883
Methanone, (1-amino-8,9-dihydro-8,8-dimethyl-5-propyl-6H-furo(2,3-b)pyrano(4,3-d)pyridin-2-yl)phenyl-
CID 1894276
(3R,4S)-1-(furan-2-carbonyl)-3-N-hydroxy-4-N-[4-[(2-methylquinolin-4-yl)methoxy]phenyl]piperidine-3,4-dicarboxamide
CID 44356953
2-(furan-2-yl)-N-(4-methoxyphenyl)quinoline-4-carboxamide
CID 903397
Methyl 1-(2-(furan-2-yl)quinoline-4-carbonyl)piperidine-4-carboxylate
CID 2420130
1-(4-(2-(5-Methylfuran-2-yl)quinoline-4-carbonyl)piperazin-1-yl)ethan-1-one
CID 24980435
6-Methoxy-2-(piperidin-1-ylcarbonyl)furo[2,3-b]quinoline
CID 3237525
(3R,4S)-1-(furan-2-carbonyl)-4-N-hydroxy-3-N-[4-[(2-methylquinolin-4-yl)methoxy]phenyl]piperidine-3,4-dicarboxamide
CID 44357209
N-[2-(5-methoxy-2-phenylfuro[3,2-b]pyridin-3-yl)ethyl]acetamide
CID 127042142
N-[2-[2-(4-fluorophenyl)-5-methoxyfuro[3,2-b]pyridin-3-yl]ethyl]acetamide
CID 127042442

Frequently Asked Questions

What is the IUPAC name of N-[3-(3,5-dimethylpiperidin-1-yl)propyl]-4-methylfuro[3,2-c]quinoline-2-carboxamide?
The IUPAC name of N-[3-(3,5-dimethylpiperidin-1-yl)propyl]-4-methylfuro[3,2-c]quinoline-2-carboxamide (CID 20868564) is N-[3-(3,5-dimethylpiperidin-1-yl)propyl]-4-methylfuro[3,2-c]quinoline-2-carboxamide.
What is the SMILES notation for N-[3-(3,5-dimethylpiperidin-1-yl)propyl]-4-methylfuro[3,2-c]quinoline-2-carboxamide?
The canonical SMILES for N-[3-(3,5-dimethylpiperidin-1-yl)propyl]-4-methylfuro[3,2-c]quinoline-2-carboxamide is Cc1nc2ccccc2c2oc(C(=O)NCCCN3CC(C)CC(C)C3)cc12.
What is the InChIKey of N-[3-(3,5-dimethylpiperidin-1-yl)propyl]-4-methylfuro[3,2-c]quinoline-2-carboxamide?
The InChIKey is QNYWPZZDXOOIGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H29N3O2/c1-15-11-16(2)14-26(13-15)10-6-9-24-23(27)21-12-19-17(3)25-20-8-5-4-7-18(20)22(19)28-21/h4-5,7-8,12,15-16H,6,9-11,13-14H2,1-3H3,(H,24,27).
What are the key properties of N-[3-(3,5-dimethylpiperidin-1-yl)propyl]-4-methylfuro[3,2-c]quinoline-2-carboxamide?
N-[3-(3,5-dimethylpiperidin-1-yl)propyl]-4-methylfuro[3,2-c]quinoline-2-carboxamide has a molecular weight of 379.50 g/mol, XLogP of 4.39, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(3,5-dimethylpiperidin-1-yl)propyl]-4-methylfuro[3,2-c]quinoline-2-carboxamide is sourced from PubChem (CID 20868564), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).