4-[(3-aminocyclopentanecarbonyl)amino]cyclohexane-1-carboxamide

C13H23N3O2 — CID 66032881

IUPAC4-[(3-aminocyclopentanecarbonyl)amino]cyclohexane-1-carboxamide
SMILESNC(=O)C1CCC(NC(=O)C2CCC(N)C2)CC1
InChIInChI=1S/C13H23N3O2/c14-10-4-1-9(7-10)13(18)16-11-5-2-8(3-6-11)12(15)17/h8-11H,1-7,14H2,(H2,15,17)(H,16,18)
InChIKeyGOBLZCSFZDPFKG-UHFFFAOYSA-N
MW253.35 g/mol
LogP0.27
Rot. Bonds3

About 4-[(3-aminocyclopentanecarbonyl)amino]cyclohexane-1-carboxamide

4-[(3-aminocyclopentanecarbonyl)amino]cyclohexane-1-carboxamide (PubChem CID 66032881) has the molecular formula C13H23N3O2 and a molecular weight of 253.35 g/mol. Its IUPAC name is 4-[(3-aminocyclopentanecarbonyl)amino]cyclohexane-1-carboxamide.

Molecular Properties

Compound Name4-[(3-aminocyclopentanecarbonyl)amino]cyclohexane-1-carboxamide
PubChem CID66032881
Molecular FormulaC13H23N3O2
Molecular Weight253.35 g/mol
Exact Mass253.18
IUPAC Name4-[(3-aminocyclopentanecarbonyl)amino]cyclohexane-1-carboxamide
SMILESNC(=O)C1CCC(NC(=O)C2CCC(N)C2)CC1
InChIInChI=1S/C13H23N3O2/c14-10-4-1-9(7-10)13(18)16-11-5-2-8(3-6-11)12(15)17/h8-11H,1-7,14H2,(H2,15,17)(H,16,18)
InChIKeyGOBLZCSFZDPFKG-UHFFFAOYSA-N
XLogP0.27
TPSA98.21 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.35
LogP ≤ 50.27
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

3-amino-N-(4-carbamoylcyclohexyl)cyclohexane-1-carboxamide
CID 63043224
3-amino-N-cyclopropylcyclohexane-1-carboxamide
CID 18071393
3-amino-N-(4-propan-2-ylcyclohexyl)cyclopentane-1-carboxamide;hydrochloride
CID 119812000
3-amino-N-(1,1-dioxothian-4-yl)cyclopentane-1-carboxamide
CID 66032491
3-amino-N-(thian-4-yl)cyclopentane-1-carboxamide;hydrochloride
CID 119765678
4-amino-N-cyclopropylcyclohexane-1-carboxamide;hydrochloride
CID 66868284
methyl 3-[(3-aminocyclopentanecarbonyl)amino]cyclopentane-1-carboxylate
CID 169045886
3-amino-N-pyrrolidin-3-ylcyclopentane-1-carboxamide
CID 130840799
N-(4-carbamoylcyclohexyl)-2-methylpiperidine-4-carboxamide
CID 106738893
3-amino-N-pyrrolidin-3-ylcyclopentane-1-carboxamide;hydrochloride
CID 130840798
3-amino-N-(1-methylpyrrolidin-3-yl)cyclopentane-1-carboxamide
CID 66007963
3-aminocyclopentane-1-carbohydrazide
CID 66010273

Frequently Asked Questions

What is the IUPAC name of 4-[(3-aminocyclopentanecarbonyl)amino]cyclohexane-1-carboxamide?
The IUPAC name of 4-[(3-aminocyclopentanecarbonyl)amino]cyclohexane-1-carboxamide (CID 66032881) is 4-[(3-aminocyclopentanecarbonyl)amino]cyclohexane-1-carboxamide.
What is the SMILES notation for 4-[(3-aminocyclopentanecarbonyl)amino]cyclohexane-1-carboxamide?
The canonical SMILES for 4-[(3-aminocyclopentanecarbonyl)amino]cyclohexane-1-carboxamide is NC(=O)C1CCC(NC(=O)C2CCC(N)C2)CC1.
What is the InChIKey of 4-[(3-aminocyclopentanecarbonyl)amino]cyclohexane-1-carboxamide?
The InChIKey is GOBLZCSFZDPFKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N3O2/c14-10-4-1-9(7-10)13(18)16-11-5-2-8(3-6-11)12(15)17/h8-11H,1-7,14H2,(H2,15,17)(H,16,18).
What are the key properties of 4-[(3-aminocyclopentanecarbonyl)amino]cyclohexane-1-carboxamide?
4-[(3-aminocyclopentanecarbonyl)amino]cyclohexane-1-carboxamide has a molecular weight of 253.35 g/mol, XLogP of 0.27, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(3-aminocyclopentanecarbonyl)amino]cyclohexane-1-carboxamide is sourced from PubChem (CID 66032881), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).