1-amino-N-(3-amino-3-oxopropyl)cyclohexane-1-carboxamide

C10H19N3O2 — CID 43553625

IUPAC1-amino-N-(3-amino-3-oxopropyl)cyclohexane-1-carboxamide
SMILESNC(=O)CCNC(=O)C1(N)CCCCC1
InChIInChI=1S/C10H19N3O2/c11-8(14)4-7-13-9(15)10(12)5-2-1-3-6-10/h1-7,12H2,(H2,11,14)(H,13,15)
InChIKeyYZJORUZNDKGVQS-UHFFFAOYSA-N
MW213.28 g/mol
LogP-0.36
Rot. Bonds4

About 1-amino-N-(3-amino-3-oxopropyl)cyclohexane-1-carboxamide

1-amino-N-(3-amino-3-oxopropyl)cyclohexane-1-carboxamide (PubChem CID 43553625) has the molecular formula C10H19N3O2 and a molecular weight of 213.28 g/mol. Its IUPAC name is 1-amino-N-(3-amino-3-oxopropyl)cyclohexane-1-carboxamide.

Molecular Properties

Compound Name1-amino-N-(3-amino-3-oxopropyl)cyclohexane-1-carboxamide
PubChem CID43553625
Molecular FormulaC10H19N3O2
Molecular Weight213.28 g/mol
Exact Mass213.15
IUPAC Name1-amino-N-(3-amino-3-oxopropyl)cyclohexane-1-carboxamide
SMILESNC(=O)CCNC(=O)C1(N)CCCCC1
InChIInChI=1S/C10H19N3O2/c11-8(14)4-7-13-9(15)10(12)5-2-1-3-6-10/h1-7,12H2,(H2,11,14)(H,13,15)
InChIKeyYZJORUZNDKGVQS-UHFFFAOYSA-N
XLogP-0.36
TPSA98.21 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.28
LogP ≤ 5-0.36
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

1-amino-N-(3-oxo-3-piperidin-1-ylpropyl)cyclohexane-1-carboxamide
CID 115733771
methyl 3-[(1-aminocyclohexanecarbonyl)amino]propanoate;hydrochloride
CID 119291127
N-(3-amino-3-oxopropyl)-1-(N'-hydroxycarbamimidoyl)cyclohexane-1-carboxamide
CID 76920303
1-amino-N-[3-(cyclohexylamino)-3-oxopropyl]cyclopentane-1-carboxamide;hydrochloride
CID 119299492
1-amino-N-[3-oxo-3-(propylamino)propyl]cyclopentane-1-carboxamide;hydrochloride
CID 119301742
1-amino-N-(cyanomethyl)cyclohexane-1-carboxamide
CID 11194684
1-(aminomethyl)-N-(3-amino-3-oxopropyl)cyclopropane-1-carboxamide
CID 80588317
ethyl 3-[(1-aminocyclobutanecarbonyl)amino]propanoate
CID 81169398
1-amino-N-[2-(cyclopropanecarbonylamino)ethyl]cyclohexane-1-carboxamide
CID 115733626
N-(3-acetamidopropyl)-1-aminocyclohexane-1-carboxamide;hydrochloride
CID 119290745
1-amino-N-(3-methylbutyl)cyclopentane-1-carboxamide
CID 60866848
(2S)-4-[(1-aminocyclohexanecarbonyl)amino]-2-hydroxybutanoic acid
CID 114006870

Frequently Asked Questions

What is the IUPAC name of 1-amino-N-(3-amino-3-oxopropyl)cyclohexane-1-carboxamide?
The IUPAC name of 1-amino-N-(3-amino-3-oxopropyl)cyclohexane-1-carboxamide (CID 43553625) is 1-amino-N-(3-amino-3-oxopropyl)cyclohexane-1-carboxamide.
What is the SMILES notation for 1-amino-N-(3-amino-3-oxopropyl)cyclohexane-1-carboxamide?
The canonical SMILES for 1-amino-N-(3-amino-3-oxopropyl)cyclohexane-1-carboxamide is NC(=O)CCNC(=O)C1(N)CCCCC1.
What is the InChIKey of 1-amino-N-(3-amino-3-oxopropyl)cyclohexane-1-carboxamide?
The InChIKey is YZJORUZNDKGVQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N3O2/c11-8(14)4-7-13-9(15)10(12)5-2-1-3-6-10/h1-7,12H2,(H2,11,14)(H,13,15).
What are the key properties of 1-amino-N-(3-amino-3-oxopropyl)cyclohexane-1-carboxamide?
1-amino-N-(3-amino-3-oxopropyl)cyclohexane-1-carboxamide has a molecular weight of 213.28 g/mol, XLogP of -0.36, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-N-(3-amino-3-oxopropyl)cyclohexane-1-carboxamide is sourced from PubChem (CID 43553625), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).