2-amino-N-[2-[cyclopropyl(methyl)amino]propyl]cyclopentane-1-carboxamide;dihydrochloride

C13H27Cl2N3O — CID 119875547

IUPAC2-amino-N-[2-[cyclopropyl(methyl)amino]propyl]cyclopentane-1-carboxamide;dihydrochloride
SMILESCC(CNC(=O)C1CCCC1N)N(C)C1CC1.Cl.Cl
InChIInChI=1S/C13H25N3O.2ClH/c1-9(16(2)10-6-7-10)8-15-13(17)11-4-3-5-12(11)14;;/h9-12H,3-8,14H2,1-2H3,(H,15,17);2*1H
InChIKeyLPBQYAPBDNMTSD-UHFFFAOYSA-N
MW312.29 g/mol
LogP1.56
Rot. Bonds5

About 2-amino-N-[2-[cyclopropyl(methyl)amino]propyl]cyclopentane-1-carboxamide;dihydrochloride

2-amino-N-[2-[cyclopropyl(methyl)amino]propyl]cyclopentane-1-carboxamide;dihydrochloride (PubChem CID 119875547) has the molecular formula C13H27Cl2N3O and a molecular weight of 312.29 g/mol. Its IUPAC name is 2-amino-N-[2-[cyclopropyl(methyl)amino]propyl]cyclopentane-1-carboxamide;dihydrochloride.

Molecular Properties

Compound Name2-amino-N-[2-[cyclopropyl(methyl)amino]propyl]cyclopentane-1-carboxamide;dihydrochloride
PubChem CID119875547
Molecular FormulaC13H27Cl2N3O
Molecular Weight312.29 g/mol
Exact Mass311.15
IUPAC Name2-amino-N-[2-[cyclopropyl(methyl)amino]propyl]cyclopentane-1-carboxamide;dihydrochloride
SMILESCC(CNC(=O)C1CCCC1N)N(C)C1CC1.Cl.Cl
InChIInChI=1S/C13H25N3O.2ClH/c1-9(16(2)10-6-7-10)8-15-13(17)11-4-3-5-12(11)14;;/h9-12H,3-8,14H2,1-2H3,(H,15,17);2*1H
InChIKeyLPBQYAPBDNMTSD-UHFFFAOYSA-N
XLogP1.56
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.29
LogP ≤ 51.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(aminomethyl)-N-[2-[cyclopropyl(methyl)amino]propyl]cyclopentane-1-carboxamide
CID 113269315
3-[(2-aminocyclopentanecarbonyl)amino]-2-methylpropanoic acid
CID 64824640
2-amino-N-[(2S)-2-hydroxypropyl]cyclohexane-1-carboxamide
CID 107221074
2-amino-N-[2-(dimethylamino)-3-methylbutyl]cyclohexane-1-carboxamide
CID 64822467
3-[[(2-aminocyclopentanecarbonyl)amino]methyl]pentanoic acid
CID 81073216
(3S,4S)-N-[2-[cyclopropyl(methyl)amino]propyl]-4-methylpyrrolidine-3-carboxamide
CID 114134011
2-amino-N-(2-hydroxypentyl)cyclopentane-1-carboxamide
CID 115739388
2-amino-N-(2-hydroxy-4-methylpentyl)cyclopentane-1-carboxamide
CID 103812101
2-amino-N-[2-(dimethylamino)-2-oxoethyl]cyclopentane-1-carboxamide;hydrochloride
CID 119689245
2-amino-N-[2-[cyclopentyl(methyl)amino]ethyl]cyclopentane-1-carboxamide;dihydrochloride
CID 119878729
(3S)-3-[[(2-aminocyclopentanecarbonyl)amino]methyl]-5-methylhexanoic acid
CID 65495163
cis-(1R,3S)-3-[2-[cyclopropyl(methyl)amino]propylcarbamoyl]-2,2-dimethylcyclopropane-1-carboxylic acid
CID 114132555

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[2-[cyclopropyl(methyl)amino]propyl]cyclopentane-1-carboxamide;dihydrochloride?
The IUPAC name of 2-amino-N-[2-[cyclopropyl(methyl)amino]propyl]cyclopentane-1-carboxamide;dihydrochloride (CID 119875547) is 2-amino-N-[2-[cyclopropyl(methyl)amino]propyl]cyclopentane-1-carboxamide;dihydrochloride.
What is the SMILES notation for 2-amino-N-[2-[cyclopropyl(methyl)amino]propyl]cyclopentane-1-carboxamide;dihydrochloride?
The canonical SMILES for 2-amino-N-[2-[cyclopropyl(methyl)amino]propyl]cyclopentane-1-carboxamide;dihydrochloride is CC(CNC(=O)C1CCCC1N)N(C)C1CC1.Cl.Cl.
What is the InChIKey of 2-amino-N-[2-[cyclopropyl(methyl)amino]propyl]cyclopentane-1-carboxamide;dihydrochloride?
The InChIKey is LPBQYAPBDNMTSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N3O.2ClH/c1-9(16(2)10-6-7-10)8-15-13(17)11-4-3-5-12(11)14;;/h9-12H,3-8,14H2,1-2H3,(H,15,17);2*1H.
What are the key properties of 2-amino-N-[2-[cyclopropyl(methyl)amino]propyl]cyclopentane-1-carboxamide;dihydrochloride?
2-amino-N-[2-[cyclopropyl(methyl)amino]propyl]cyclopentane-1-carboxamide;dihydrochloride has a molecular weight of 312.29 g/mol, XLogP of 1.56, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[2-[cyclopropyl(methyl)amino]propyl]cyclopentane-1-carboxamide;dihydrochloride is sourced from PubChem (CID 119875547), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).