1-(cyclopropylamino)-3-[ethyl(propan-2-yl)amino]cyclopentane-1-carboxamide

C14H27N3O — CID 79655102

IUPAC1-(cyclopropylamino)-3-[ethyl(propan-2-yl)amino]cyclopentane-1-carboxamide
SMILESCCN(C(C)C)C1CCC(NC2CC2)(C(N)=O)C1
InChIInChI=1S/C14H27N3O/c1-4-17(10(2)3)12-7-8-14(9-12,13(15)18)16-11-5-6-11/h10-12,16H,4-9H2,1-3H3,(H2,15,18)
InChIKeyDYMLRVOMLQLZKI-UHFFFAOYSA-N
MW253.39 g/mol
LogP1.25
Rot. Bonds6

About 1-(cyclopropylamino)-3-[ethyl(propan-2-yl)amino]cyclopentane-1-carboxamide

1-(cyclopropylamino)-3-[ethyl(propan-2-yl)amino]cyclopentane-1-carboxamide (PubChem CID 79655102) has the molecular formula C14H27N3O and a molecular weight of 253.39 g/mol. Its IUPAC name is 1-(cyclopropylamino)-3-[ethyl(propan-2-yl)amino]cyclopentane-1-carboxamide.

Molecular Properties

Compound Name1-(cyclopropylamino)-3-[ethyl(propan-2-yl)amino]cyclopentane-1-carboxamide
PubChem CID79655102
Molecular FormulaC14H27N3O
Molecular Weight253.39 g/mol
Exact Mass253.22
IUPAC Name1-(cyclopropylamino)-3-[ethyl(propan-2-yl)amino]cyclopentane-1-carboxamide
SMILESCCN(C(C)C)C1CCC(NC2CC2)(C(N)=O)C1
InChIInChI=1S/C14H27N3O/c1-4-17(10(2)3)12-7-8-14(9-12,13(15)18)16-11-5-6-11/h10-12,16H,4-9H2,1-3H3,(H2,15,18)
InChIKeyDYMLRVOMLQLZKI-UHFFFAOYSA-N
XLogP1.25
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.39
LogP ≤ 51.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-(cyclopropylamino)-3-[propan-2-yl(2,2,2-trifluoroethyl)amino]cyclopentane-1-carboxamide
CID 79646367
3-[cyclopentyl(ethyl)amino]-1-(cyclopropylamino)cyclopentane-1-carboxamide
CID 79655119
3-[butan-2-yl(ethyl)amino]-1-(cyclopropylamino)cyclopentane-1-carboxylic acid
CID 79655033
methyl 1-(cyclopropylamino)-3-[ethyl(propan-2-yl)amino]cyclohexane-1-carboxylate
CID 79636681
1-(cyclopropylamino)-3-[propan-2-yl(propyl)amino]cyclopentane-1-carboxylic acid
CID 79655109
methyl 1-(cyclopropylamino)-3-[cyclopropylmethyl(propan-2-yl)amino]cyclopentane-1-carboxylate
CID 79647441
methyl 1-(cyclopropylamino)-3-[ethyl(1-methoxypropan-2-yl)amino]cyclopentane-1-carboxylate
CID 79646396
1-(cyclopropylamino)-3-[propyl(2,2,2-trifluoroethyl)amino]cyclopentane-1-carboxamide
CID 79646385
3-[butyl(ethyl)amino]-1-(cyclopropylamino)cyclohexane-1-carboxamide
CID 79636571
1-(cyclopropylamino)-3-methylcyclopentane-1-carboxamide
CID 64513100
3-[ethyl(methyl)amino]-1-(propan-2-ylamino)cyclopentane-1-carboxamide
CID 79654805
1-(cyclopropylamino)-3-[methyl(oxolan-2-ylmethyl)amino]cyclopentane-1-carboxamide
CID 79655154

Frequently Asked Questions

What is the IUPAC name of 1-(cyclopropylamino)-3-[ethyl(propan-2-yl)amino]cyclopentane-1-carboxamide?
The IUPAC name of 1-(cyclopropylamino)-3-[ethyl(propan-2-yl)amino]cyclopentane-1-carboxamide (CID 79655102) is 1-(cyclopropylamino)-3-[ethyl(propan-2-yl)amino]cyclopentane-1-carboxamide.
What is the SMILES notation for 1-(cyclopropylamino)-3-[ethyl(propan-2-yl)amino]cyclopentane-1-carboxamide?
The canonical SMILES for 1-(cyclopropylamino)-3-[ethyl(propan-2-yl)amino]cyclopentane-1-carboxamide is CCN(C(C)C)C1CCC(NC2CC2)(C(N)=O)C1.
What is the InChIKey of 1-(cyclopropylamino)-3-[ethyl(propan-2-yl)amino]cyclopentane-1-carboxamide?
The InChIKey is DYMLRVOMLQLZKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N3O/c1-4-17(10(2)3)12-7-8-14(9-12,13(15)18)16-11-5-6-11/h10-12,16H,4-9H2,1-3H3,(H2,15,18).
What are the key properties of 1-(cyclopropylamino)-3-[ethyl(propan-2-yl)amino]cyclopentane-1-carboxamide?
1-(cyclopropylamino)-3-[ethyl(propan-2-yl)amino]cyclopentane-1-carboxamide has a molecular weight of 253.39 g/mol, XLogP of 1.25, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclopropylamino)-3-[ethyl(propan-2-yl)amino]cyclopentane-1-carboxamide is sourced from PubChem (CID 79655102), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).