4-(cyclooctylamino)-N-ethylpyridine-2-carboxamide

C16H25N3O — CID 43517873

IUPAC4-(cyclooctylamino)-N-ethylpyridine-2-carboxamide
SMILESCCNC(=O)c1cc(NC2CCCCCCC2)ccn1
InChIInChI=1S/C16H25N3O/c1-2-17-16(20)15-12-14(10-11-18-15)19-13-8-6-4-3-5-7-9-13/h10-13H,2-9H2,1H3,(H,17,20)(H,18,19)
InChIKeyRETVFYNAPDLKDD-UHFFFAOYSA-N
MW275.40 g/mol
LogP3.36
Rot. Bonds4

About 4-(cyclooctylamino)-N-ethylpyridine-2-carboxamide

4-(cyclooctylamino)-N-ethylpyridine-2-carboxamide (PubChem CID 43517873) has the molecular formula C16H25N3O and a molecular weight of 275.40 g/mol. Its IUPAC name is 4-(cyclooctylamino)-N-ethylpyridine-2-carboxamide.

Molecular Properties

Compound Name4-(cyclooctylamino)-N-ethylpyridine-2-carboxamide
PubChem CID43517873
Molecular FormulaC16H25N3O
Molecular Weight275.40 g/mol
Exact Mass275.20
IUPAC Name4-(cyclooctylamino)-N-ethylpyridine-2-carboxamide
SMILESCCNC(=O)c1cc(NC2CCCCCCC2)ccn1
InChIInChI=1S/C16H25N3O/c1-2-17-16(20)15-12-14(10-11-18-15)19-13-8-6-4-3-5-7-9-13/h10-13H,2-9H2,1H3,(H,17,20)(H,18,19)
InChIKeyRETVFYNAPDLKDD-UHFFFAOYSA-N
XLogP3.36
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.40
LogP ≤ 53.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-(cycloheptylamino)-N-ethylpyridine-2-carboxamide
CID 43517906
N-butyl-4-(cyclopentylamino)pyridine-2-carboxamide
CID 109202468
4-(cycloheptylamino)-N-(3-methoxypropyl)pyridine-2-carboxamide
CID 109206087
N-butan-2-yl-4-(cyclopentylamino)pyridine-2-carboxamide
CID 109203234
2-[[2-(ethylcarbamoyl)-4-pyridinyl]amino]cyclopentane-1-carboxylic acid
CID 64816659
N-ethyl-4-[(2-methylsulfanylcyclopentyl)amino]pyridine-2-carboxamide
CID 103704015
N-ethyl-4-[(2-methylpiperidin-3-yl)amino]pyridine-2-carboxamide
CID 114695697
N-ethyl-4-[(2-oxopiperidin-3-yl)amino]pyridine-2-carboxamide
CID 55033632
4-(3-azabicyclo[3.1.0]hexan-6-ylamino)-N-ethylpyridine-2-carboxamide
CID 43599108
N-ethyl-4-[(2-methyloxolan-3-yl)amino]pyridine-2-carboxamide
CID 82728955
N-cyclohexyl-4-(ethylamino)pyridine-2-carboxamide
CID 62171612
4-(cyclohexylamino)-N-[2-(4-methoxyphenyl)ethyl]pyridine-2-carboxamide
CID 109204933

Frequently Asked Questions

What is the IUPAC name of 4-(cyclooctylamino)-N-ethylpyridine-2-carboxamide?
The IUPAC name of 4-(cyclooctylamino)-N-ethylpyridine-2-carboxamide (CID 43517873) is 4-(cyclooctylamino)-N-ethylpyridine-2-carboxamide.
What is the SMILES notation for 4-(cyclooctylamino)-N-ethylpyridine-2-carboxamide?
The canonical SMILES for 4-(cyclooctylamino)-N-ethylpyridine-2-carboxamide is CCNC(=O)c1cc(NC2CCCCCCC2)ccn1.
What is the InChIKey of 4-(cyclooctylamino)-N-ethylpyridine-2-carboxamide?
The InChIKey is RETVFYNAPDLKDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N3O/c1-2-17-16(20)15-12-14(10-11-18-15)19-13-8-6-4-3-5-7-9-13/h10-13H,2-9H2,1H3,(H,17,20)(H,18,19).
What are the key properties of 4-(cyclooctylamino)-N-ethylpyridine-2-carboxamide?
4-(cyclooctylamino)-N-ethylpyridine-2-carboxamide has a molecular weight of 275.40 g/mol, XLogP of 3.36, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(cyclooctylamino)-N-ethylpyridine-2-carboxamide is sourced from PubChem (CID 43517873), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).