6-amino-5-chloro-N-cyclooctylpyridine-3-carboxamide

C14H20ClN3O — CID 62152170

IUPAC6-amino-5-chloro-N-cyclooctylpyridine-3-carboxamide
SMILESNc1ncc(C(=O)NC2CCCCCCC2)cc1Cl
InChIInChI=1S/C14H20ClN3O/c15-12-8-10(9-17-13(12)16)14(19)18-11-6-4-2-1-3-5-7-11/h8-9,11H,1-7H2,(H2,16,17)(H,18,19)
InChIKeyZPUVFWTXMIKBDK-UHFFFAOYSA-N
MW281.79 g/mol
LogP3.16
Rot. Bonds2

About 6-amino-5-chloro-N-cyclooctylpyridine-3-carboxamide

6-amino-5-chloro-N-cyclooctylpyridine-3-carboxamide (PubChem CID 62152170) has the molecular formula C14H20ClN3O and a molecular weight of 281.79 g/mol. Its IUPAC name is 6-amino-5-chloro-N-cyclooctylpyridine-3-carboxamide.

Molecular Properties

Compound Name6-amino-5-chloro-N-cyclooctylpyridine-3-carboxamide
PubChem CID62152170
Molecular FormulaC14H20ClN3O
Molecular Weight281.79 g/mol
Exact Mass281.13
IUPAC Name6-amino-5-chloro-N-cyclooctylpyridine-3-carboxamide
SMILESNc1ncc(C(=O)NC2CCCCCCC2)cc1Cl
InChIInChI=1S/C14H20ClN3O/c15-12-8-10(9-17-13(12)16)14(19)18-11-6-4-2-1-3-5-7-11/h8-9,11H,1-7H2,(H2,16,17)(H,18,19)
InChIKeyZPUVFWTXMIKBDK-UHFFFAOYSA-N
XLogP3.16
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.79
LogP ≤ 53.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

6-amino-5-chloro-N-(4-hydroxycyclohexyl)pyridine-3-carboxamide
CID 62155376
6-amino-5-chloro-N-(5-oxopyrrolidin-3-yl)pyridine-3-carboxamide
CID 113429241
6-amino-5-chloro-N-(2-cyclopentylethyl)pyridine-3-carboxamide
CID 62161812
6-amino-N-(1,2,3,5,6,7,8,8a-octahydroindolizin-7-yl)-5-chloropyridine-3-carboxamide
CID 78916895
6-amino-5-chloro-N-(2,2-dimethyloxan-4-yl)pyridine-3-carboxamide
CID 115563972
3-amino-4,5-dichloro-N-cyclooctylbenzamide
CID 61090105
6-amino-5-chloro-N-(cyclobutylmethyl)pyridine-3-carboxamide
CID 62155457
6-amino-5-chloro-N-(2,4-dimethylcyclohexyl)pyridine-3-carboxamide
CID 63999211
6-amino-5-chloro-N-(7-oxabicyclo[2.2.1]heptan-2-yl)pyridine-3-carboxamide
CID 80602684
2,6-dichloro-N-cyclohexylpyridine-4-carboxamide
CID 26719449
3-N-cyclopentyl-5-N-cyclopropylpyridine-3,5-dicarboxamide
CID 109101527
3,5-diamino-N-cyclooctylbenzamide
CID 61092511

Frequently Asked Questions

What is the IUPAC name of 6-amino-5-chloro-N-cyclooctylpyridine-3-carboxamide?
The IUPAC name of 6-amino-5-chloro-N-cyclooctylpyridine-3-carboxamide (CID 62152170) is 6-amino-5-chloro-N-cyclooctylpyridine-3-carboxamide.
What is the SMILES notation for 6-amino-5-chloro-N-cyclooctylpyridine-3-carboxamide?
The canonical SMILES for 6-amino-5-chloro-N-cyclooctylpyridine-3-carboxamide is Nc1ncc(C(=O)NC2CCCCCCC2)cc1Cl.
What is the InChIKey of 6-amino-5-chloro-N-cyclooctylpyridine-3-carboxamide?
The InChIKey is ZPUVFWTXMIKBDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20ClN3O/c15-12-8-10(9-17-13(12)16)14(19)18-11-6-4-2-1-3-5-7-11/h8-9,11H,1-7H2,(H2,16,17)(H,18,19).
What are the key properties of 6-amino-5-chloro-N-cyclooctylpyridine-3-carboxamide?
6-amino-5-chloro-N-cyclooctylpyridine-3-carboxamide has a molecular weight of 281.79 g/mol, XLogP of 3.16, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-5-chloro-N-cyclooctylpyridine-3-carboxamide is sourced from PubChem (CID 62152170), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).