(2S)-N-(2-bicyclo[2.2.1]heptanylmethyl)piperidine-2-carboxamide;hydrochloride

C14H25ClN2O — CID 119756599

IUPAC(2S)-N-(2-bicyclo[2.2.1]heptanylmethyl)piperidine-2-carboxamide;hydrochloride
SMILESCl.O=C(NCC1CC2CCC1C2)[C@@H]1CCCCN1
InChIInChI=1S/C14H24N2O.ClH/c17-14(13-3-1-2-6-15-13)16-9-12-8-10-4-5-11(12)7-10;/h10-13,15H,1-9H2,(H,16,17);1H/t10?,11?,12?,13-;/m0./s1
InChIKeyANZLTXNQCGIBMZ-HDOKGEMUSA-N
MW272.82 g/mol
LogP2.10
Rot. Bonds3

About (2S)-N-(2-bicyclo[2.2.1]heptanylmethyl)piperidine-2-carboxamide;hydrochloride

(2S)-N-(2-bicyclo[2.2.1]heptanylmethyl)piperidine-2-carboxamide;hydrochloride (PubChem CID 119756599) has the molecular formula C14H25ClN2O and a molecular weight of 272.82 g/mol. Its IUPAC name is (2S)-N-(2-bicyclo[2.2.1]heptanylmethyl)piperidine-2-carboxamide;hydrochloride.

Molecular Properties

Compound Name(2S)-N-(2-bicyclo[2.2.1]heptanylmethyl)piperidine-2-carboxamide;hydrochloride
PubChem CID119756599
Molecular FormulaC14H25ClN2O
Molecular Weight272.82 g/mol
Exact Mass272.17
IUPAC Name(2S)-N-(2-bicyclo[2.2.1]heptanylmethyl)piperidine-2-carboxamide;hydrochloride
SMILESCl.O=C(NCC1CC2CCC1C2)[C@@H]1CCCCN1
InChIInChI=1S/C14H24N2O.ClH/c17-14(13-3-1-2-6-15-13)16-9-12-8-10-4-5-11(12)7-10;/h10-13,15H,1-9H2,(H,16,17);1H/t10?,11?,12?,13-;/m0./s1
InChIKeyANZLTXNQCGIBMZ-HDOKGEMUSA-N
XLogP2.10
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.82
LogP ≤ 52.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-bicyclo[2.2.1]heptanylmethyl)-1,3-thiazolidine-4-carboxamide
CID 63683998
N-[(2-hydroxycyclopentyl)methyl]piperidine-2-carboxamide;hydrochloride
CID 111463943
(2S)-N-[(2-methylcyclohexyl)methyl]piperidine-2-carboxamide
CID 103809808
N-(cyclooctylmethyl)piperidine-2-carboxamide;hydrochloride
CID 119299438
N-(2-bicyclo[2.2.1]heptanylmethyl)-4-hydroxypyrrolidine-2-carboxamide
CID 55234438
(2R)-N-[(2-methylcyclopentyl)methyl]piperidine-2-carboxamide
CID 107418450
(2R)-N-[(2-methylcyclopropyl)methyl]pyrrolidine-2-carboxamide
CID 103795243
2-[[[(2R)-pyrrolidine-2-carbonyl]amino]methyl]cyclohexane-1-carboxylic acid
CID 104901218
N-(thian-2-ylmethyl)piperidine-2-carboxamide
CID 80599886
(2S)-N-[(2,2-dimethylcyclopropyl)methyl]piperidine-2-carboxamide;hydrochloride
CID 119785410
(2R)-N-[(4-hydroxycyclohexyl)methyl]piperidine-2-carboxamide
CID 106135357
(2S)-N-(thiolan-3-ylmethyl)piperidine-2-carboxamide
CID 107296038

Frequently Asked Questions

What is the IUPAC name of (2S)-N-(2-bicyclo[2.2.1]heptanylmethyl)piperidine-2-carboxamide;hydrochloride?
The IUPAC name of (2S)-N-(2-bicyclo[2.2.1]heptanylmethyl)piperidine-2-carboxamide;hydrochloride (CID 119756599) is (2S)-N-(2-bicyclo[2.2.1]heptanylmethyl)piperidine-2-carboxamide;hydrochloride.
What is the SMILES notation for (2S)-N-(2-bicyclo[2.2.1]heptanylmethyl)piperidine-2-carboxamide;hydrochloride?
The canonical SMILES for (2S)-N-(2-bicyclo[2.2.1]heptanylmethyl)piperidine-2-carboxamide;hydrochloride is Cl.O=C(NCC1CC2CCC1C2)[C@@H]1CCCCN1.
What is the InChIKey of (2S)-N-(2-bicyclo[2.2.1]heptanylmethyl)piperidine-2-carboxamide;hydrochloride?
The InChIKey is ANZLTXNQCGIBMZ-HDOKGEMUSA-N. The full InChI is InChI=1S/C14H24N2O.ClH/c17-14(13-3-1-2-6-15-13)16-9-12-8-10-4-5-11(12)7-10;/h10-13,15H,1-9H2,(H,16,17);1H/t10?,11?,12?,13-;/m0./s1.
What are the key properties of (2S)-N-(2-bicyclo[2.2.1]heptanylmethyl)piperidine-2-carboxamide;hydrochloride?
(2S)-N-(2-bicyclo[2.2.1]heptanylmethyl)piperidine-2-carboxamide;hydrochloride has a molecular weight of 272.82 g/mol, XLogP of 2.10, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-N-(2-bicyclo[2.2.1]heptanylmethyl)piperidine-2-carboxamide;hydrochloride is sourced from PubChem (CID 119756599), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).