2-amino-N-(2-pyridin-3-ylethyl)cyclohexane-1-carboxamide

C14H21N3O — CID 64822976

IUPAC2-amino-N-(2-pyridin-3-ylethyl)cyclohexane-1-carboxamide
SMILESNC1CCCCC1C(=O)NCCc1cccnc1
InChIInChI=1S/C14H21N3O/c15-13-6-2-1-5-12(13)14(18)17-9-7-11-4-3-8-16-10-11/h3-4,8,10,12-13H,1-2,5-7,9,15H2,(H,17,18)
InChIKeyPQKCUEBDPZTDQI-UHFFFAOYSA-N
MW247.34 g/mol
LogP1.26
Rot. Bonds4

About 2-amino-N-(2-pyridin-3-ylethyl)cyclohexane-1-carboxamide

2-amino-N-(2-pyridin-3-ylethyl)cyclohexane-1-carboxamide (PubChem CID 64822976) has the molecular formula C14H21N3O and a molecular weight of 247.34 g/mol. Its IUPAC name is 2-amino-N-(2-pyridin-3-ylethyl)cyclohexane-1-carboxamide.

Molecular Properties

Compound Name2-amino-N-(2-pyridin-3-ylethyl)cyclohexane-1-carboxamide
PubChem CID64822976
Molecular FormulaC14H21N3O
Molecular Weight247.34 g/mol
Exact Mass247.17
IUPAC Name2-amino-N-(2-pyridin-3-ylethyl)cyclohexane-1-carboxamide
SMILESNC1CCCCC1C(=O)NCCc1cccnc1
InChIInChI=1S/C14H21N3O/c15-13-6-2-1-5-12(13)14(18)17-9-7-11-4-3-8-16-10-11/h3-4,8,10,12-13H,1-2,5-7,9,15H2,(H,17,18)
InChIKeyPQKCUEBDPZTDQI-UHFFFAOYSA-N
XLogP1.26
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.34
LogP ≤ 51.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-amino-N-(2-pyridin-3-ylethyl)cyclobutane-1-carboxamide
CID 115161689
2-(2-pyridin-3-ylethylcarbamoylamino)cyclohexane-1-carboxylic acid
CID 64817875
2-amino-N-(3-phenylpropyl)cyclopentane-1-carboxamide
CID 64823369
2-(cyclopentylamino)-N-(2-pyridin-3-ylethyl)acetamide
CID 60912902
1-(2-hydroxycyclohexyl)-3-(2-pyridin-3-ylethyl)urea
CID 110933231
2-amino-N-methyl-N-(pyridin-3-ylmethyl)cyclohexane-1-carboxamide
CID 64824292
N-(2-pyridin-3-ylethyl)-1,2,3,3a,4,5,6,6a-octahydrocyclopenta[c]pyrrole-3-carboxamide
CID 102891385
N-(2-pyridin-3-ylethyl)piperidine-3-carboxamide;dihydrochloride
CID 119842424
2-amino-N-pyridin-3-ylcyclopentane-1-carboxamide
CID 64817349
2-amino-N-[2-(1,3-thiazol-2-yl)ethyl]cyclohexane-1-carboxamide
CID 64825025
cis-(1R,2S)-2-hydroxy-N-(2-phenylethyl)cyclohexane-1-carboxamide
CID 13313986
2-amino-N-[2-(4-methoxyphenyl)ethyl]cyclopentane-1-carboxamide
CID 64817742

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(2-pyridin-3-ylethyl)cyclohexane-1-carboxamide?
The IUPAC name of 2-amino-N-(2-pyridin-3-ylethyl)cyclohexane-1-carboxamide (CID 64822976) is 2-amino-N-(2-pyridin-3-ylethyl)cyclohexane-1-carboxamide.
What is the SMILES notation for 2-amino-N-(2-pyridin-3-ylethyl)cyclohexane-1-carboxamide?
The canonical SMILES for 2-amino-N-(2-pyridin-3-ylethyl)cyclohexane-1-carboxamide is NC1CCCCC1C(=O)NCCc1cccnc1.
What is the InChIKey of 2-amino-N-(2-pyridin-3-ylethyl)cyclohexane-1-carboxamide?
The InChIKey is PQKCUEBDPZTDQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O/c15-13-6-2-1-5-12(13)14(18)17-9-7-11-4-3-8-16-10-11/h3-4,8,10,12-13H,1-2,5-7,9,15H2,(H,17,18).
What are the key properties of 2-amino-N-(2-pyridin-3-ylethyl)cyclohexane-1-carboxamide?
2-amino-N-(2-pyridin-3-ylethyl)cyclohexane-1-carboxamide has a molecular weight of 247.34 g/mol, XLogP of 1.26, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(2-pyridin-3-ylethyl)cyclohexane-1-carboxamide is sourced from PubChem (CID 64822976), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).