7-cyclopropyl-N-(4-hydroxy-4-methylcyclohexyl)-1,8-naphthyridine-3-carboxamide

C19H23N3O2 — CID 137362985

IUPAC7-cyclopropyl-N-(4-hydroxy-4-methylcyclohexyl)-1,8-naphthyridine-3-carboxamide
SMILESCC1(O)CCC(NC(=O)c2cnc3nc(C4CC4)ccc3c2)CC1
InChIInChI=1S/C19H23N3O2/c1-19(24)8-6-15(7-9-19)21-18(23)14-10-13-4-5-16(12-2-3-12)22-17(13)20-11-14/h4-5,10-12,15,24H,2-3,6-9H2,1H3,(H,21,23)
InChIKeyQKSCKMUQTPEEDV-UHFFFAOYSA-N
MW325.41 g/mol
LogP2.93
Rot. Bonds3

About 7-cyclopropyl-N-(4-hydroxy-4-methylcyclohexyl)-1,8-naphthyridine-3-carboxamide

7-cyclopropyl-N-(4-hydroxy-4-methylcyclohexyl)-1,8-naphthyridine-3-carboxamide (PubChem CID 137362985) has the molecular formula C19H23N3O2 and a molecular weight of 325.41 g/mol. Its IUPAC name is 7-cyclopropyl-N-(4-hydroxy-4-methylcyclohexyl)-1,8-naphthyridine-3-carboxamide.

Molecular Properties

Compound Name7-cyclopropyl-N-(4-hydroxy-4-methylcyclohexyl)-1,8-naphthyridine-3-carboxamide
PubChem CID137362985
Molecular FormulaC19H23N3O2
Molecular Weight325.41 g/mol
Exact Mass325.18
IUPAC Name7-cyclopropyl-N-(4-hydroxy-4-methylcyclohexyl)-1,8-naphthyridine-3-carboxamide
SMILESCC1(O)CCC(NC(=O)c2cnc3nc(C4CC4)ccc3c2)CC1
InChIInChI=1S/C19H23N3O2/c1-19(24)8-6-15(7-9-19)21-18(23)14-10-13-4-5-16(12-2-3-12)22-17(13)20-11-14/h4-5,10-12,15,24H,2-3,6-9H2,1H3,(H,21,23)
InChIKeyQKSCKMUQTPEEDV-UHFFFAOYSA-N
XLogP2.93
TPSA75.11 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.41
LogP ≤ 52.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 7-cyclopropyl-N-(4-hydroxy-4-methylcyclohexyl)-1,8-naphthyridine-3-carboxamide?
The IUPAC name of 7-cyclopropyl-N-(4-hydroxy-4-methylcyclohexyl)-1,8-naphthyridine-3-carboxamide (CID 137362985) is 7-cyclopropyl-N-(4-hydroxy-4-methylcyclohexyl)-1,8-naphthyridine-3-carboxamide.
What is the SMILES notation for 7-cyclopropyl-N-(4-hydroxy-4-methylcyclohexyl)-1,8-naphthyridine-3-carboxamide?
The canonical SMILES for 7-cyclopropyl-N-(4-hydroxy-4-methylcyclohexyl)-1,8-naphthyridine-3-carboxamide is CC1(O)CCC(NC(=O)c2cnc3nc(C4CC4)ccc3c2)CC1.
What is the InChIKey of 7-cyclopropyl-N-(4-hydroxy-4-methylcyclohexyl)-1,8-naphthyridine-3-carboxamide?
The InChIKey is QKSCKMUQTPEEDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O2/c1-19(24)8-6-15(7-9-19)21-18(23)14-10-13-4-5-16(12-2-3-12)22-17(13)20-11-14/h4-5,10-12,15,24H,2-3,6-9H2,1H3,(H,21,23).
What are the key properties of 7-cyclopropyl-N-(4-hydroxy-4-methylcyclohexyl)-1,8-naphthyridine-3-carboxamide?
7-cyclopropyl-N-(4-hydroxy-4-methylcyclohexyl)-1,8-naphthyridine-3-carboxamide has a molecular weight of 325.41 g/mol, XLogP of 2.93, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-cyclopropyl-N-(4-hydroxy-4-methylcyclohexyl)-1,8-naphthyridine-3-carboxamide is sourced from PubChem (CID 137362985), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).