N'-(2-cyclopentyl-2-methylpropyl)-2-methylpropane-1,3-diamine

C13H28N2 — CID 115198967

IUPACN'-(2-cyclopentyl-2-methylpropyl)-2-methylpropane-1,3-diamine
SMILESCC(CN)CNCC(C)(C)C1CCCC1
InChIInChI=1S/C13H28N2/c1-11(8-14)9-15-10-13(2,3)12-6-4-5-7-12/h11-12,15H,4-10,14H2,1-3H3
InChIKeyGAWIYVYDRPWLQK-UHFFFAOYSA-N
MW212.38 g/mol
LogP2.39
Rot. Bonds6

About N'-(2-cyclopentyl-2-methylpropyl)-2-methylpropane-1,3-diamine

N'-(2-cyclopentyl-2-methylpropyl)-2-methylpropane-1,3-diamine (PubChem CID 115198967) has the molecular formula C13H28N2 and a molecular weight of 212.38 g/mol. Its IUPAC name is N'-(2-cyclopentyl-2-methylpropyl)-2-methylpropane-1,3-diamine.

Molecular Properties

Compound NameN'-(2-cyclopentyl-2-methylpropyl)-2-methylpropane-1,3-diamine
PubChem CID115198967
Molecular FormulaC13H28N2
Molecular Weight212.38 g/mol
Exact Mass212.23
IUPAC NameN'-(2-cyclopentyl-2-methylpropyl)-2-methylpropane-1,3-diamine
SMILESCC(CN)CNCC(C)(C)C1CCCC1
InChIInChI=1S/C13H28N2/c1-11(8-14)9-15-10-13(2,3)12-6-4-5-7-12/h11-12,15H,4-10,14H2,1-3H3
InChIKeyGAWIYVYDRPWLQK-UHFFFAOYSA-N
XLogP2.39
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.38
LogP ≤ 52.39
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
N-(2-cyclopentyl-2-methylpropyl)-N'-methyl-2-propan-2-ylpropane-1,3-diamine
CID 115252969
4-amino-N-(2-cyclohexyl-2-methylpropyl)-3-methylbutanamide
CID 115156526
1-N-(2-cyclopentyl-2-methylpropyl)-2-methylpropane-1,2-diamine
CID 115136380
N-(2-cyclopentyl-2-methylpropyl)-2-ethyl-N'-methylpropane-1,3-diamine
CID 115255240
2-methyl-N'-(2,2,3,3-tetramethylbutyl)propane-1,3-diamine
CID 115198913
2-N-(2-cyclobutyl-2-methylpropyl)-3-methylbutane-1,2-diamine
CID 115138420
2-cyclobutyl-N-(hydrazinylmethyl)-2-methylpropan-1-amine
CID 115261517
3-amino-N-(2-cyclopentyl-2-methylpropyl)butanamide
CID 115154472
1-[[(2-cyclohexyl-2-methylpropyl)amino]methyl]cyclopropan-1-amine
CID 115257163
2-cyclohexyl-2-methylpropan-1-amine
CID 19776368
2-cycloheptyl-2-methylpropan-1-amine
CID 82934909

Frequently Asked Questions

What is the IUPAC name of N'-(2-cyclopentyl-2-methylpropyl)-2-methylpropane-1,3-diamine?
The IUPAC name of N'-(2-cyclopentyl-2-methylpropyl)-2-methylpropane-1,3-diamine (CID 115198967) is N'-(2-cyclopentyl-2-methylpropyl)-2-methylpropane-1,3-diamine.
What is the SMILES notation for N'-(2-cyclopentyl-2-methylpropyl)-2-methylpropane-1,3-diamine?
The canonical SMILES for N'-(2-cyclopentyl-2-methylpropyl)-2-methylpropane-1,3-diamine is CC(CN)CNCC(C)(C)C1CCCC1.
What is the InChIKey of N'-(2-cyclopentyl-2-methylpropyl)-2-methylpropane-1,3-diamine?
The InChIKey is GAWIYVYDRPWLQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28N2/c1-11(8-14)9-15-10-13(2,3)12-6-4-5-7-12/h11-12,15H,4-10,14H2,1-3H3.
What are the key properties of N'-(2-cyclopentyl-2-methylpropyl)-2-methylpropane-1,3-diamine?
N'-(2-cyclopentyl-2-methylpropyl)-2-methylpropane-1,3-diamine has a molecular weight of 212.38 g/mol, XLogP of 2.39, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(2-cyclopentyl-2-methylpropyl)-2-methylpropane-1,3-diamine is sourced from PubChem (CID 115198967), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).