N-[(1S)-1-pyridin-2-ylethyl]cyclohexanecarboxamide

C14H20N2O — CID 92852511

IUPACN-[(1S)-1-pyridin-2-ylethyl]cyclohexanecarboxamide
SMILESC[C@H](NC(=O)C1CCCCC1)c1ccccn1
InChIInChI=1S/C14H20N2O/c1-11(13-9-5-6-10-15-13)16-14(17)12-7-3-2-4-8-12/h5-6,9-12H,2-4,7-8H2,1H3,(H,16,17)/t11-/m0/s1
InChIKeyWPEPSHQLSXSEMO-NSHDSACASA-N
MW232.33 g/mol
LogP2.84
Rot. Bonds3

About N-[(1S)-1-pyridin-2-ylethyl]cyclohexanecarboxamide

N-[(1S)-1-pyridin-2-ylethyl]cyclohexanecarboxamide (PubChem CID 92852511) has the molecular formula C14H20N2O and a molecular weight of 232.33 g/mol. Its IUPAC name is N-[(1S)-1-pyridin-2-ylethyl]cyclohexanecarboxamide.

Molecular Properties

Compound NameN-[(1S)-1-pyridin-2-ylethyl]cyclohexanecarboxamide
PubChem CID92852511
Molecular FormulaC14H20N2O
Molecular Weight232.33 g/mol
Exact Mass232.16
IUPAC NameN-[(1S)-1-pyridin-2-ylethyl]cyclohexanecarboxamide
SMILESC[C@H](NC(=O)C1CCCCC1)c1ccccn1
InChIInChI=1S/C14H20N2O/c1-11(13-9-5-6-10-15-13)16-14(17)12-7-3-2-4-8-12/h5-6,9-12H,2-4,7-8H2,1H3,(H,16,17)/t11-/m0/s1
InChIKeyWPEPSHQLSXSEMO-NSHDSACASA-N
XLogP2.84
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.33
LogP ≤ 52.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-oxo-2-[[(1R)-1-pyridin-2-ylethyl]amino]ethyl]cyclohexanecarboxamide
CID 92829486
(3S)-N-[(1R)-1-pyridin-2-ylethyl]piperidine-3-carboxamide
CID 81407106
N-(1-pyridin-2-ylethyl)cyclohex-3-ene-1-carboxamide
CID 42905815
(3R)-1-(2-methylpropanoyl)-N-[(1S)-1-pyridin-2-ylethyl]piperidine-3-carboxamide
CID 94091157
3-amino-N-[(1S)-1-pyridin-2-ylethyl]cyclopentane-1-carboxamide
CID 81407435
(2S)-N-(1-pyridin-2-ylethyl)piperidine-2-carboxamide
CID 103813258
(3R)-1,1-dioxo-N-[(1S)-1-pyridin-2-ylethyl]thiolane-3-carboxamide
CID 39996283
N-[3-[[(1S)-1-pyridin-2-ylethyl]amino]phenyl]cyclohexanecarboxamide
CID 124614551
2-amino-N-[(1R)-1-pyridin-2-ylethyl]cyclopentane-1-carboxamide
CID 81407618
ethyl 4-[[(1S)-1-pyridin-2-ylethyl]carbamoyl]piperidine-1-carboxylate
CID 35939336
1-benzoyl-N-(1-pyridin-2-ylethyl)piperidine-2-carboxamide
CID 136575876
N-(1-pyridin-2-ylethyl)piperidine-1-carboxamide
CID 113221669

Frequently Asked Questions

What is the IUPAC name of N-[(1S)-1-pyridin-2-ylethyl]cyclohexanecarboxamide?
The IUPAC name of N-[(1S)-1-pyridin-2-ylethyl]cyclohexanecarboxamide (CID 92852511) is N-[(1S)-1-pyridin-2-ylethyl]cyclohexanecarboxamide.
What is the SMILES notation for N-[(1S)-1-pyridin-2-ylethyl]cyclohexanecarboxamide?
The canonical SMILES for N-[(1S)-1-pyridin-2-ylethyl]cyclohexanecarboxamide is C[C@H](NC(=O)C1CCCCC1)c1ccccn1.
What is the InChIKey of N-[(1S)-1-pyridin-2-ylethyl]cyclohexanecarboxamide?
The InChIKey is WPEPSHQLSXSEMO-NSHDSACASA-N. The full InChI is InChI=1S/C14H20N2O/c1-11(13-9-5-6-10-15-13)16-14(17)12-7-3-2-4-8-12/h5-6,9-12H,2-4,7-8H2,1H3,(H,16,17)/t11-/m0/s1.
What are the key properties of N-[(1S)-1-pyridin-2-ylethyl]cyclohexanecarboxamide?
N-[(1S)-1-pyridin-2-ylethyl]cyclohexanecarboxamide has a molecular weight of 232.33 g/mol, XLogP of 2.84, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1S)-1-pyridin-2-ylethyl]cyclohexanecarboxamide is sourced from PubChem (CID 92852511), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).