N-(cyclohexylmethyl)-2-(naphthalene-1-carbonylamino)pyridine-3-carboxamide

C24H25N3O2 — CID 71546015

IUPACN-(cyclohexylmethyl)-2-(naphthalene-1-carbonylamino)pyridine-3-carboxamide
SMILESO=C(NCC1CCCCC1)c1cccnc1NC(=O)c1cccc2ccccc12
InChIInChI=1S/C24H25N3O2/c28-23(26-16-17-8-2-1-3-9-17)21-14-7-15-25-22(21)27-24(29)20-13-6-11-18-10-4-5-12-19(18)20/h4-7,10-15,17H,1-3,8-9,16H2,(H,26,28)(H,25,27,29)
InChIKeyFSQHUGISRUAOMQ-UHFFFAOYSA-N
MW387.48 g/mol
LogP4.80
Rot. Bonds5

About N-(cyclohexylmethyl)-2-(naphthalene-1-carbonylamino)pyridine-3-carboxamide

N-(cyclohexylmethyl)-2-(naphthalene-1-carbonylamino)pyridine-3-carboxamide (PubChem CID 71546015) has the molecular formula C24H25N3O2 and a molecular weight of 387.48 g/mol. Its IUPAC name is N-(cyclohexylmethyl)-2-(naphthalene-1-carbonylamino)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(cyclohexylmethyl)-2-(naphthalene-1-carbonylamino)pyridine-3-carboxamide
PubChem CID71546015
Molecular FormulaC24H25N3O2
Molecular Weight387.48 g/mol
Exact Mass387.19
IUPAC NameN-(cyclohexylmethyl)-2-(naphthalene-1-carbonylamino)pyridine-3-carboxamide
SMILESO=C(NCC1CCCCC1)c1cccnc1NC(=O)c1cccc2ccccc12
InChIInChI=1S/C24H25N3O2/c28-23(26-16-17-8-2-1-3-9-17)21-14-7-15-25-22(21)27-24(29)20-13-6-11-18-10-4-5-12-19(18)20/h4-7,10-15,17H,1-3,8-9,16H2,(H,26,28)(H,25,27,29)
InChIKeyFSQHUGISRUAOMQ-UHFFFAOYSA-N
XLogP4.80
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500387.48
LogP ≤ 54.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(cyclohexylmethyl)-2-(naphthalene-1-carbonylamino)pyridine-3-carboxamide?
The IUPAC name of N-(cyclohexylmethyl)-2-(naphthalene-1-carbonylamino)pyridine-3-carboxamide (CID 71546015) is N-(cyclohexylmethyl)-2-(naphthalene-1-carbonylamino)pyridine-3-carboxamide.
What is the SMILES notation for N-(cyclohexylmethyl)-2-(naphthalene-1-carbonylamino)pyridine-3-carboxamide?
The canonical SMILES for N-(cyclohexylmethyl)-2-(naphthalene-1-carbonylamino)pyridine-3-carboxamide is O=C(NCC1CCCCC1)c1cccnc1NC(=O)c1cccc2ccccc12.
What is the InChIKey of N-(cyclohexylmethyl)-2-(naphthalene-1-carbonylamino)pyridine-3-carboxamide?
The InChIKey is FSQHUGISRUAOMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H25N3O2/c28-23(26-16-17-8-2-1-3-9-17)21-14-7-15-25-22(21)27-24(29)20-13-6-11-18-10-4-5-12-19(18)20/h4-7,10-15,17H,1-3,8-9,16H2,(H,26,28)(H,25,27,29).
What are the key properties of N-(cyclohexylmethyl)-2-(naphthalene-1-carbonylamino)pyridine-3-carboxamide?
N-(cyclohexylmethyl)-2-(naphthalene-1-carbonylamino)pyridine-3-carboxamide has a molecular weight of 387.48 g/mol, XLogP of 4.80, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclohexylmethyl)-2-(naphthalene-1-carbonylamino)pyridine-3-carboxamide is sourced from PubChem (CID 71546015), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).