2-N-cyclopentyl-2-N,3-dimethylpentane-1,2-diamine

C12H26N2 — CID 43312482

IUPAC2-N-cyclopentyl-2-N,3-dimethylpentane-1,2-diamine
SMILESCCC(C)C(CN)N(C)C1CCCC1
InChIInChI=1S/C12H26N2/c1-4-10(2)12(9-13)14(3)11-7-5-6-8-11/h10-12H,4-9,13H2,1-3H3
InChIKeyWELJXCITFXFETK-UHFFFAOYSA-N
MW198.35 g/mol
LogP2.23
Rot. Bonds5

About 2-N-cyclopentyl-2-N,3-dimethylpentane-1,2-diamine

2-N-cyclopentyl-2-N,3-dimethylpentane-1,2-diamine (PubChem CID 43312482) has the molecular formula C12H26N2 and a molecular weight of 198.35 g/mol. Its IUPAC name is 2-N-cyclopentyl-2-N,3-dimethylpentane-1,2-diamine.

Molecular Properties

Compound Name2-N-cyclopentyl-2-N,3-dimethylpentane-1,2-diamine
PubChem CID43312482
Molecular FormulaC12H26N2
Molecular Weight198.35 g/mol
Exact Mass198.21
IUPAC Name2-N-cyclopentyl-2-N,3-dimethylpentane-1,2-diamine
SMILESCCC(C)C(CN)N(C)C1CCCC1
InChIInChI=1S/C12H26N2/c1-4-10(2)12(9-13)14(3)11-7-5-6-8-11/h10-12H,4-9,13H2,1-3H3
InChIKeyWELJXCITFXFETK-UHFFFAOYSA-N
XLogP2.23
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.35
LogP ≤ 52.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-N-cyclopentyl-2-N,3,3-trimethylbutane-1,2-diamine
CID 61326826
tert-butyl N-[4-amino-3-[cycloheptyl(methyl)amino]butan-2-yl]carbamate
CID 102729640
1-[cyclopentyl(methyl)amino]propan-1-ol
CID 175919705
2-N-cyclohexyl-2-N-ethylpropane-1,2-diamine
CID 16784373
2-N-cyclopentyl-2-N,4,4-trimethylpentane-1,2-diamine
CID 62951525
tert-butyl N-[4-amino-3-[cyclobutyl(methyl)amino]butan-2-yl]carbamate
CID 102730487
2-N-cyclopentyl-2-N-propan-2-ylpropane-1,2-diamine
CID 83817405
ethane;N-methyl-N-propan-2-ylcyclohexanamine;propane
CID 142239228
3-amino-2-[cycloheptyl(methyl)amino]propan-1-ol
CID 104710851
1-N-tert-butyl-2-N-cyclohexyl-2-N,3-dimethylbutane-1,2-diamine
CID 62423532
N'-cyclopentyl-N',2-dimethylpropane-1,3-diamine
CID 43266901
1-(4-tert-butylcyclohexyl)-N-cyclopentyl-N-methylethane-1,2-diamine
CID 104575342

Frequently Asked Questions

What is the IUPAC name of 2-N-cyclopentyl-2-N,3-dimethylpentane-1,2-diamine?
The IUPAC name of 2-N-cyclopentyl-2-N,3-dimethylpentane-1,2-diamine (CID 43312482) is 2-N-cyclopentyl-2-N,3-dimethylpentane-1,2-diamine.
What is the SMILES notation for 2-N-cyclopentyl-2-N,3-dimethylpentane-1,2-diamine?
The canonical SMILES for 2-N-cyclopentyl-2-N,3-dimethylpentane-1,2-diamine is CCC(C)C(CN)N(C)C1CCCC1.
What is the InChIKey of 2-N-cyclopentyl-2-N,3-dimethylpentane-1,2-diamine?
The InChIKey is WELJXCITFXFETK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2/c1-4-10(2)12(9-13)14(3)11-7-5-6-8-11/h10-12H,4-9,13H2,1-3H3.
What are the key properties of 2-N-cyclopentyl-2-N,3-dimethylpentane-1,2-diamine?
2-N-cyclopentyl-2-N,3-dimethylpentane-1,2-diamine has a molecular weight of 198.35 g/mol, XLogP of 2.23, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-cyclopentyl-2-N,3-dimethylpentane-1,2-diamine is sourced from PubChem (CID 43312482), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).