1-N-(2-cyclopentyl-2-methylpropyl)-2-methylpropane-1,2-diamine

C13H28N2 — CID 115136380

IUPAC1-N-(2-cyclopentyl-2-methylpropyl)-2-methylpropane-1,2-diamine
SMILESCC(C)(N)CNCC(C)(C)C1CCCC1
InChIInChI=1S/C13H28N2/c1-12(2,11-7-5-6-8-11)9-15-10-13(3,4)14/h11,15H,5-10,14H2,1-4H3
InChIKeyFODBJTQPOOAXFI-UHFFFAOYSA-N
MW212.38 g/mol
LogP2.53
Rot. Bonds5

About 1-N-(2-cyclopentyl-2-methylpropyl)-2-methylpropane-1,2-diamine

1-N-(2-cyclopentyl-2-methylpropyl)-2-methylpropane-1,2-diamine (PubChem CID 115136380) has the molecular formula C13H28N2 and a molecular weight of 212.38 g/mol. Its IUPAC name is 1-N-(2-cyclopentyl-2-methylpropyl)-2-methylpropane-1,2-diamine.

Molecular Properties

Compound Name1-N-(2-cyclopentyl-2-methylpropyl)-2-methylpropane-1,2-diamine
PubChem CID115136380
Molecular FormulaC13H28N2
Molecular Weight212.38 g/mol
Exact Mass212.23
IUPAC Name1-N-(2-cyclopentyl-2-methylpropyl)-2-methylpropane-1,2-diamine
SMILESCC(C)(N)CNCC(C)(C)C1CCCC1
InChIInChI=1S/C13H28N2/c1-12(2,11-7-5-6-8-11)9-15-10-13(3,4)14/h11,15H,5-10,14H2,1-4H3
InChIKeyFODBJTQPOOAXFI-UHFFFAOYSA-N
XLogP2.53
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.38
LogP ≤ 52.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N'-(2-cyclopentyl-2-methylpropyl)-2,2-dimethylpropane-1,3-diamine
CID 115200319
2-[(2-cyclohexyl-2-methylpropyl)amino]acetaldehyde
CID 115223611
2-cyclobutyl-N-(hydrazinylmethyl)-2-methylpropan-1-amine
CID 115261517
4-[[(2-cyclopentyl-2-methylpropyl)amino]methyl]cyclohexan-1-ol
CID 115239975
1-[[(2-cyclohexyl-2-methylpropyl)amino]methyl]cyclopropan-1-amine
CID 115257163
4-[[(2-cyclohexyl-2-methylpropyl)amino]methyl]cyclohexan-1-one
CID 115240315
2-[(2-cyclohexyl-2-methylpropyl)amino]ethanol
CID 115216597
methyl 2-[(2-cyclopentyl-2-methylpropyl)amino]acetate
CID 115233257
N-(azetidin-3-ylmethyl)-2-cyclohexyl-2-methylpropan-1-amine
CID 115208032
N'-(2-cyclopentyl-2-methylpropyl)-2-methylpropane-1,3-diamine
CID 115198967
2-cyclopentyl-2-methyl-N-(oxolan-3-ylmethyl)propan-1-amine
CID 115888052
1-[(2-cyclobutyl-2-methylpropyl)amino]propan-2-one
CID 115235348

Frequently Asked Questions

What is the IUPAC name of 1-N-(2-cyclopentyl-2-methylpropyl)-2-methylpropane-1,2-diamine?
The IUPAC name of 1-N-(2-cyclopentyl-2-methylpropyl)-2-methylpropane-1,2-diamine (CID 115136380) is 1-N-(2-cyclopentyl-2-methylpropyl)-2-methylpropane-1,2-diamine.
What is the SMILES notation for 1-N-(2-cyclopentyl-2-methylpropyl)-2-methylpropane-1,2-diamine?
The canonical SMILES for 1-N-(2-cyclopentyl-2-methylpropyl)-2-methylpropane-1,2-diamine is CC(C)(N)CNCC(C)(C)C1CCCC1.
What is the InChIKey of 1-N-(2-cyclopentyl-2-methylpropyl)-2-methylpropane-1,2-diamine?
The InChIKey is FODBJTQPOOAXFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28N2/c1-12(2,11-7-5-6-8-11)9-15-10-13(3,4)14/h11,15H,5-10,14H2,1-4H3.
What are the key properties of 1-N-(2-cyclopentyl-2-methylpropyl)-2-methylpropane-1,2-diamine?
1-N-(2-cyclopentyl-2-methylpropyl)-2-methylpropane-1,2-diamine has a molecular weight of 212.38 g/mol, XLogP of 2.53, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N-(2-cyclopentyl-2-methylpropyl)-2-methylpropane-1,2-diamine is sourced from PubChem (CID 115136380), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).