N-[4-[(4-chloro-3-pyridinyl)carbamoyl]cyclohexyl]-6-methoxy-1,5-naphthyridine-4-carboxamide

C22H22ClN5O3 — CID 134497899

IUPACN-[4-[(4-chloro-3-pyridinyl)carbamoyl]cyclohexyl]-6-methoxy-1,5-naphthyridine-4-carboxamide
SMILESCOc1ccc2nccc(C(=O)NC3CCC(C(=O)Nc4cnccc4Cl)CC3)c2n1
InChIInChI=1S/C22H22ClN5O3/c1-31-19-7-6-17-20(28-19)15(8-11-25-17)22(30)26-14-4-2-13(3-5-14)21(29)27-18-12-24-10-9-16(18)23/h6-14H,2-5H2,1H3,(H,26,30)(H,27,29)
InChIKeyWOJCENZPWSTCOZ-UHFFFAOYSA-N
MW439.90 g/mol
LogP3.61
Rot. Bonds5

About N-[4-[(4-chloro-3-pyridinyl)carbamoyl]cyclohexyl]-6-methoxy-1,5-naphthyridine-4-carboxamide

N-[4-[(4-chloro-3-pyridinyl)carbamoyl]cyclohexyl]-6-methoxy-1,5-naphthyridine-4-carboxamide (PubChem CID 134497899) has the molecular formula C22H22ClN5O3 and a molecular weight of 439.90 g/mol. Its IUPAC name is N-[4-[(4-chloro-3-pyridinyl)carbamoyl]cyclohexyl]-6-methoxy-1,5-naphthyridine-4-carboxamide.

Molecular Properties

Compound NameN-[4-[(4-chloro-3-pyridinyl)carbamoyl]cyclohexyl]-6-methoxy-1,5-naphthyridine-4-carboxamide
PubChem CID134497899
Molecular FormulaC22H22ClN5O3
Molecular Weight439.90 g/mol
Exact Mass439.14
IUPAC NameN-[4-[(4-chloro-3-pyridinyl)carbamoyl]cyclohexyl]-6-methoxy-1,5-naphthyridine-4-carboxamide
SMILESCOc1ccc2nccc(C(=O)NC3CCC(C(=O)Nc4cnccc4Cl)CC3)c2n1
InChIInChI=1S/C22H22ClN5O3/c1-31-19-7-6-17-20(28-19)15(8-11-25-17)22(30)26-14-4-2-13(3-5-14)21(29)27-18-12-24-10-9-16(18)23/h6-14H,2-5H2,1H3,(H,26,30)(H,27,29)
InChIKeyWOJCENZPWSTCOZ-UHFFFAOYSA-N
XLogP3.61
TPSA106.10 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500439.90
LogP ≤ 53.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze N-[4-[(4-chloro-3-pyridinyl)carbamoyl]cyclohexyl]-6-methoxy-1,5-naphthyridine-4-carboxamide with MolForge

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Related Compounds

N-(4-chloro-3-pyridinyl)cyclopropanecarboxamide
CID 78965831
5-amino-N-(6-methoxy-1,5-naphthyridin-4-yl)-6-oxopiperidine-2-carboxamide
CID 57418806
N-(1-ethyl-4-oxo-3-phenyl-2,3-diazaspiro[4.5]dec-1-en-8-yl)-6-methoxy-1,5-naphthyridine-4-carboxamide
CID 134479377
4-(3,4-dihydro-2H-1,4-benzoxazin-6-ylmethylamino)-N-(6-methoxy-1,5-naphthyridin-4-yl)cyclohexane-1-carboxamide
CID 10343587
N-cyclopropyl-3-(methylamino)pyridine-4-carboxamide
CID 105068162
3-methoxy-N-[4-(methylamino)cyclohexyl]pyridine-4-carboxamide
CID 105063330
2-methoxy-N-[4-(pyridin-3-ylcarbamoyl)cyclohexyl]benzamide
CID 154762622
(1R)-4-[(7-fluoro-3-oxo-4,9-dihydro-[1,4]thiazino[3,2-b]azepin-6-yl)methylamino]-N-(6-methoxy-1,5-naphthyridin-4-yl)cycloheptane-1-carboxamide;methanol
CID 142817627
3-[(3-methoxypyridine-4-carbonyl)amino]cyclopentane-1-carboxylic acid
CID 105063233
N-(4-bromocyclohexyl)-3-methoxypyridine-4-carboxamide
CID 105064552
N-(4-chloro-3-pyridinyl)oxane-3-carboxamide
CID 103745000
(4R)-4-amino-N-(6-methoxy-1,5-naphthyridin-4-yl)cyclohexene-1-carboxamide
CID 91309040

Frequently Asked Questions

What is the IUPAC name of N-[4-[(4-chloro-3-pyridinyl)carbamoyl]cyclohexyl]-6-methoxy-1,5-naphthyridine-4-carboxamide?
The IUPAC name of N-[4-[(4-chloro-3-pyridinyl)carbamoyl]cyclohexyl]-6-methoxy-1,5-naphthyridine-4-carboxamide (CID 134497899) is N-[4-[(4-chloro-3-pyridinyl)carbamoyl]cyclohexyl]-6-methoxy-1,5-naphthyridine-4-carboxamide.
What is the SMILES notation for N-[4-[(4-chloro-3-pyridinyl)carbamoyl]cyclohexyl]-6-methoxy-1,5-naphthyridine-4-carboxamide?
The canonical SMILES for N-[4-[(4-chloro-3-pyridinyl)carbamoyl]cyclohexyl]-6-methoxy-1,5-naphthyridine-4-carboxamide is COc1ccc2nccc(C(=O)NC3CCC(C(=O)Nc4cnccc4Cl)CC3)c2n1.
What is the InChIKey of N-[4-[(4-chloro-3-pyridinyl)carbamoyl]cyclohexyl]-6-methoxy-1,5-naphthyridine-4-carboxamide?
The InChIKey is WOJCENZPWSTCOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H22ClN5O3/c1-31-19-7-6-17-20(28-19)15(8-11-25-17)22(30)26-14-4-2-13(3-5-14)21(29)27-18-12-24-10-9-16(18)23/h6-14H,2-5H2,1H3,(H,26,30)(H,27,29).
What are the key properties of N-[4-[(4-chloro-3-pyridinyl)carbamoyl]cyclohexyl]-6-methoxy-1,5-naphthyridine-4-carboxamide?
N-[4-[(4-chloro-3-pyridinyl)carbamoyl]cyclohexyl]-6-methoxy-1,5-naphthyridine-4-carboxamide has a molecular weight of 439.90 g/mol, XLogP of 3.61, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[(4-chloro-3-pyridinyl)carbamoyl]cyclohexyl]-6-methoxy-1,5-naphthyridine-4-carboxamide is sourced from PubChem (CID 134497899), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).