4-(cyclopentanecarbonylamino)-N-(piperidin-3-ylmethyl)cyclohexane-1-carboxamide;hydrochloride

C19H34ClN3O2 — CID 119463290

IUPAC4-(cyclopentanecarbonylamino)-N-(piperidin-3-ylmethyl)cyclohexane-1-carboxamide;hydrochloride
SMILESCl.O=C(NCC1CCCNC1)C1CCC(NC(=O)C2CCCC2)CC1
InChIInChI=1S/C19H33N3O2.ClH/c23-18(21-13-14-4-3-11-20-12-14)16-7-9-17(10-8-16)22-19(24)15-5-1-2-6-15;/h14-17,20H,1-13H2,(H,21,23)(H,22,24);1H
InChIKeyUXGWCWJICFYXHE-UHFFFAOYSA-N
MW371.95 g/mol
LogP2.39
Rot. Bonds5

About 4-(cyclopentanecarbonylamino)-N-(piperidin-3-ylmethyl)cyclohexane-1-carboxamide;hydrochloride

4-(cyclopentanecarbonylamino)-N-(piperidin-3-ylmethyl)cyclohexane-1-carboxamide;hydrochloride (PubChem CID 119463290) has the molecular formula C19H34ClN3O2 and a molecular weight of 371.95 g/mol. Its IUPAC name is 4-(cyclopentanecarbonylamino)-N-(piperidin-3-ylmethyl)cyclohexane-1-carboxamide;hydrochloride.

Molecular Properties

Compound Name4-(cyclopentanecarbonylamino)-N-(piperidin-3-ylmethyl)cyclohexane-1-carboxamide;hydrochloride
PubChem CID119463290
Molecular FormulaC19H34ClN3O2
Molecular Weight371.95 g/mol
Exact Mass371.23
IUPAC Name4-(cyclopentanecarbonylamino)-N-(piperidin-3-ylmethyl)cyclohexane-1-carboxamide;hydrochloride
SMILESCl.O=C(NCC1CCCNC1)C1CCC(NC(=O)C2CCCC2)CC1
InChIInChI=1S/C19H33N3O2.ClH/c23-18(21-13-14-4-3-11-20-12-14)16-7-9-17(10-8-16)22-19(24)15-5-1-2-6-15;/h14-17,20H,1-13H2,(H,21,23)(H,22,24);1H
InChIKeyUXGWCWJICFYXHE-UHFFFAOYSA-N
XLogP2.39
TPSA70.23 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.95
LogP ≤ 52.39
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-(piperidin-3-ylmethyl)cyclohexanecarboxamide;hydrochloride
CID 119260134
N-(piperidin-3-ylmethyl)cyclohexanecarboxamide
CID 18069614
N-[[(3R)-piperidin-3-yl]methyl]cycloheptanecarboxamide
CID 94502290
4-(cyclopentanecarbonylamino)-N-piperidin-3-ylcyclohexane-1-carboxamide;hydrochloride
CID 119427846
N-(cyclopentylmethyl)piperidine-3-carboxamide
CID 43371173
(3S)-N-(cyclopentylmethyl)piperidine-3-carboxamide
CID 81123262
2,2,3,3-tetramethyl-N-(piperidin-3-ylmethyl)cyclopropane-1-carboxamide
CID 66475790
N-cyclopropyl-2-(piperidin-3-ylmethylamino)acetamide
CID 80553600
N-(2-piperidin-3-ylethyl)cyclobutanecarboxamide;hydrochloride
CID 119557894
N-pyrrolidin-3-ylcyclopentanecarboxamide;hydrochloride
CID 146675555
N-(piperidin-3-ylmethyl)oxolane-3-carboxamide
CID 61271600
(3S)-N-cyclobutylpiperidine-3-carboxamide
CID 81141296

Frequently Asked Questions

What is the IUPAC name of 4-(cyclopentanecarbonylamino)-N-(piperidin-3-ylmethyl)cyclohexane-1-carboxamide;hydrochloride?
The IUPAC name of 4-(cyclopentanecarbonylamino)-N-(piperidin-3-ylmethyl)cyclohexane-1-carboxamide;hydrochloride (CID 119463290) is 4-(cyclopentanecarbonylamino)-N-(piperidin-3-ylmethyl)cyclohexane-1-carboxamide;hydrochloride.
What is the SMILES notation for 4-(cyclopentanecarbonylamino)-N-(piperidin-3-ylmethyl)cyclohexane-1-carboxamide;hydrochloride?
The canonical SMILES for 4-(cyclopentanecarbonylamino)-N-(piperidin-3-ylmethyl)cyclohexane-1-carboxamide;hydrochloride is Cl.O=C(NCC1CCCNC1)C1CCC(NC(=O)C2CCCC2)CC1.
What is the InChIKey of 4-(cyclopentanecarbonylamino)-N-(piperidin-3-ylmethyl)cyclohexane-1-carboxamide;hydrochloride?
The InChIKey is UXGWCWJICFYXHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H33N3O2.ClH/c23-18(21-13-14-4-3-11-20-12-14)16-7-9-17(10-8-16)22-19(24)15-5-1-2-6-15;/h14-17,20H,1-13H2,(H,21,23)(H,22,24);1H.
What are the key properties of 4-(cyclopentanecarbonylamino)-N-(piperidin-3-ylmethyl)cyclohexane-1-carboxamide;hydrochloride?
4-(cyclopentanecarbonylamino)-N-(piperidin-3-ylmethyl)cyclohexane-1-carboxamide;hydrochloride has a molecular weight of 371.95 g/mol, XLogP of 2.39, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(cyclopentanecarbonylamino)-N-(piperidin-3-ylmethyl)cyclohexane-1-carboxamide;hydrochloride is sourced from PubChem (CID 119463290), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).