1-[(3-aminocyclopentanecarbonyl)amino]cyclohexane-1-carboxamide;hydrochloride

C13H24ClN3O2 — CID 119735680

IUPAC1-[(3-aminocyclopentanecarbonyl)amino]cyclohexane-1-carboxamide;hydrochloride
SMILESCl.NC(=O)C1(NC(=O)C2CCC(N)C2)CCCCC1
InChIInChI=1S/C13H23N3O2.ClH/c14-10-5-4-9(8-10)11(17)16-13(12(15)18)6-2-1-3-7-13;/h9-10H,1-8,14H2,(H2,15,18)(H,16,17);1H
InChIKeyKTMPSDSCTMOUND-UHFFFAOYSA-N
MW289.81 g/mol
LogP0.84
Rot. Bonds3

About 1-[(3-aminocyclopentanecarbonyl)amino]cyclohexane-1-carboxamide;hydrochloride

1-[(3-aminocyclopentanecarbonyl)amino]cyclohexane-1-carboxamide;hydrochloride (PubChem CID 119735680) has the molecular formula C13H24ClN3O2 and a molecular weight of 289.81 g/mol. Its IUPAC name is 1-[(3-aminocyclopentanecarbonyl)amino]cyclohexane-1-carboxamide;hydrochloride.

Molecular Properties

Compound Name1-[(3-aminocyclopentanecarbonyl)amino]cyclohexane-1-carboxamide;hydrochloride
PubChem CID119735680
Molecular FormulaC13H24ClN3O2
Molecular Weight289.81 g/mol
Exact Mass289.16
IUPAC Name1-[(3-aminocyclopentanecarbonyl)amino]cyclohexane-1-carboxamide;hydrochloride
SMILESCl.NC(=O)C1(NC(=O)C2CCC(N)C2)CCCCC1
InChIInChI=1S/C13H23N3O2.ClH/c14-10-5-4-9(8-10)11(17)16-13(12(15)18)6-2-1-3-7-13;/h9-10H,1-8,14H2,(H2,15,18)(H,16,17);1H
InChIKeyKTMPSDSCTMOUND-UHFFFAOYSA-N
XLogP0.84
TPSA98.21 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.81
LogP ≤ 50.84
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

4-[(3-aminocyclopentanecarbonyl)amino]oxane-4-carboxylic acid
CID 113280324
1-[(3-aminocyclohexanecarbonyl)amino]-N-butylcyclohexane-1-carboxamide;hydrochloride
CID 119767221
1-[(3-aminocyclohexanecarbonyl)amino]-N-propylcyclohexane-1-carboxamide
CID 119767184
N-(1-adamantyl)-3-aminocyclopentane-1-carboxamide;hydrochloride
CID 119669367
4-(cyclopropanecarbonylamino)piperidine-4-carboxamide
CID 167977824
1-[(3-aminocyclohexanecarbonyl)amino]-N-butylcyclohexane-1-carboxamide
CID 119767222
3-amino-N-[1-(4-chlorophenyl)cyclopentyl]cyclopentane-1-carboxamide;hydrochloride
CID 119766556
1-[[2-(cyclopropylmethylamino)acetyl]amino]cyclohexane-1-carboxamide;hydrochloride
CID 119735692
3-aminocyclopentane-1-carbohydrazide
CID 66010273
3-amino-N-[(1-ethylcyclobutyl)methyl]cyclopentane-1-carboxamide;hydrochloride
CID 119782141
3-amino-N-[(1-ethylcyclobutyl)methyl]cyclopentane-1-carboxamide
CID 103810881
3-amino-N-[(2S)-1-amino-1-oxopropan-2-yl]cyclopentane-1-carboxamide
CID 130163371

Frequently Asked Questions

What is the IUPAC name of 1-[(3-aminocyclopentanecarbonyl)amino]cyclohexane-1-carboxamide;hydrochloride?
The IUPAC name of 1-[(3-aminocyclopentanecarbonyl)amino]cyclohexane-1-carboxamide;hydrochloride (CID 119735680) is 1-[(3-aminocyclopentanecarbonyl)amino]cyclohexane-1-carboxamide;hydrochloride.
What is the SMILES notation for 1-[(3-aminocyclopentanecarbonyl)amino]cyclohexane-1-carboxamide;hydrochloride?
The canonical SMILES for 1-[(3-aminocyclopentanecarbonyl)amino]cyclohexane-1-carboxamide;hydrochloride is Cl.NC(=O)C1(NC(=O)C2CCC(N)C2)CCCCC1.
What is the InChIKey of 1-[(3-aminocyclopentanecarbonyl)amino]cyclohexane-1-carboxamide;hydrochloride?
The InChIKey is KTMPSDSCTMOUND-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N3O2.ClH/c14-10-5-4-9(8-10)11(17)16-13(12(15)18)6-2-1-3-7-13;/h9-10H,1-8,14H2,(H2,15,18)(H,16,17);1H.
What are the key properties of 1-[(3-aminocyclopentanecarbonyl)amino]cyclohexane-1-carboxamide;hydrochloride?
1-[(3-aminocyclopentanecarbonyl)amino]cyclohexane-1-carboxamide;hydrochloride has a molecular weight of 289.81 g/mol, XLogP of 0.84, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(3-aminocyclopentanecarbonyl)amino]cyclohexane-1-carboxamide;hydrochloride is sourced from PubChem (CID 119735680), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).