2-N-[2-[cyclopentyl(methyl)amino]ethyl]propane-1,2-diamine

C11H25N3 — CID 103389932

IUPAC2-N-[2-[cyclopentyl(methyl)amino]ethyl]propane-1,2-diamine
SMILESCC(CN)NCCN(C)C1CCCC1
InChIInChI=1S/C11H25N3/c1-10(9-12)13-7-8-14(2)11-5-3-4-6-11/h10-11,13H,3-9,12H2,1-2H3
InChIKeyGJYGTOSERZYMRX-UHFFFAOYSA-N
MW199.34 g/mol
LogP0.80
Rot. Bonds6

About 2-N-[2-[cyclopentyl(methyl)amino]ethyl]propane-1,2-diamine

2-N-[2-[cyclopentyl(methyl)amino]ethyl]propane-1,2-diamine (PubChem CID 103389932) has the molecular formula C11H25N3 and a molecular weight of 199.34 g/mol. Its IUPAC name is 2-N-[2-[cyclopentyl(methyl)amino]ethyl]propane-1,2-diamine.

Molecular Properties

Compound Name2-N-[2-[cyclopentyl(methyl)amino]ethyl]propane-1,2-diamine
PubChem CID103389932
Molecular FormulaC11H25N3
Molecular Weight199.34 g/mol
Exact Mass199.20
IUPAC Name2-N-[2-[cyclopentyl(methyl)amino]ethyl]propane-1,2-diamine
SMILESCC(CN)NCCN(C)C1CCCC1
InChIInChI=1S/C11H25N3/c1-10(9-12)13-7-8-14(2)11-5-3-4-6-11/h10-11,13H,3-9,12H2,1-2H3
InChIKeyGJYGTOSERZYMRX-UHFFFAOYSA-N
XLogP0.80
TPSA41.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.34
LogP ≤ 50.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-butan-2-yl-N'-cycloheptyl-N'-methylethane-1,2-diamine
CID 60853944
N'-cyclopentyl-N'-methyl-N-(5-methylhexan-2-yl)ethane-1,2-diamine
CID 62574178
N'-cyclopentyl-N-(1-ethylsulfonylpropan-2-yl)-N'-methylethane-1,2-diamine
CID 113350762
2-[2-[cyclopentyl(methyl)amino]ethylamino]propanenitrile
CID 63318071
N'-cyclopentyl-N'-methyl-N-[1-(1-methylcyclopropyl)ethyl]ethane-1,2-diamine
CID 63314802
N'-cyclopentyl-N-[1-(4-fluorophenyl)propan-2-yl]-N'-methylethane-1,2-diamine
CID 115717758
ethyl 2-[2-[cyclopentyl(methyl)amino]ethylamino]propanoate
CID 63318117
N'-cyclopentyl-N-heptan-4-yl-N'-methylethane-1,2-diamine
CID 55205255
2-[2-[cyclopentyl(methyl)amino]ethylamino]-N,N-dimethylpropanamide
CID 63318305
methyl 3-[2-[cyclopentyl(methyl)amino]ethylamino]-2-methylbutanoate
CID 79397246
N'-cyclohexyl-N'-methyl-N-(2-methylpropyl)ethane-1,2-diamine
CID 62425000
2-N-[2-[methyl(propan-2-yl)amino]ethyl]propane-1,2-diamine
CID 103389816

Frequently Asked Questions

What is the IUPAC name of 2-N-[2-[cyclopentyl(methyl)amino]ethyl]propane-1,2-diamine?
The IUPAC name of 2-N-[2-[cyclopentyl(methyl)amino]ethyl]propane-1,2-diamine (CID 103389932) is 2-N-[2-[cyclopentyl(methyl)amino]ethyl]propane-1,2-diamine.
What is the SMILES notation for 2-N-[2-[cyclopentyl(methyl)amino]ethyl]propane-1,2-diamine?
The canonical SMILES for 2-N-[2-[cyclopentyl(methyl)amino]ethyl]propane-1,2-diamine is CC(CN)NCCN(C)C1CCCC1.
What is the InChIKey of 2-N-[2-[cyclopentyl(methyl)amino]ethyl]propane-1,2-diamine?
The InChIKey is GJYGTOSERZYMRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H25N3/c1-10(9-12)13-7-8-14(2)11-5-3-4-6-11/h10-11,13H,3-9,12H2,1-2H3.
What are the key properties of 2-N-[2-[cyclopentyl(methyl)amino]ethyl]propane-1,2-diamine?
2-N-[2-[cyclopentyl(methyl)amino]ethyl]propane-1,2-diamine has a molecular weight of 199.34 g/mol, XLogP of 0.80, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-[2-[cyclopentyl(methyl)amino]ethyl]propane-1,2-diamine is sourced from PubChem (CID 103389932), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).