1-N-(2,2-dimethylcyclopentyl)-2-N,2-N,3-trimethylbutane-1,2-diamine

C14H30N2 — CID 79864207

IUPAC1-N-(2,2-dimethylcyclopentyl)-2-N,2-N,3-trimethylbutane-1,2-diamine
SMILESCC(C)C(CNC1CCCC1(C)C)N(C)C
InChIInChI=1S/C14H30N2/c1-11(2)12(16(5)6)10-15-13-8-7-9-14(13,3)4/h11-13,15H,7-10H2,1-6H3
InChIKeyVOPBJZNHQSBQRZ-UHFFFAOYSA-N
MW226.41 g/mol
LogP2.74
Rot. Bonds5

About 1-N-(2,2-dimethylcyclopentyl)-2-N,2-N,3-trimethylbutane-1,2-diamine

1-N-(2,2-dimethylcyclopentyl)-2-N,2-N,3-trimethylbutane-1,2-diamine (PubChem CID 79864207) has the molecular formula C14H30N2 and a molecular weight of 226.41 g/mol. Its IUPAC name is 1-N-(2,2-dimethylcyclopentyl)-2-N,2-N,3-trimethylbutane-1,2-diamine.

Molecular Properties

Compound Name1-N-(2,2-dimethylcyclopentyl)-2-N,2-N,3-trimethylbutane-1,2-diamine
PubChem CID79864207
Molecular FormulaC14H30N2
Molecular Weight226.41 g/mol
Exact Mass226.24
IUPAC Name1-N-(2,2-dimethylcyclopentyl)-2-N,2-N,3-trimethylbutane-1,2-diamine
SMILESCC(C)C(CNC1CCCC1(C)C)N(C)C
InChIInChI=1S/C14H30N2/c1-11(2)12(16(5)6)10-15-13-8-7-9-14(13,3)4/h11-13,15H,7-10H2,1-6H3
InChIKeyVOPBJZNHQSBQRZ-UHFFFAOYSA-N
XLogP2.74
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.41
LogP ≤ 52.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-N-(2,2-dimethylcyclopentyl)-2-N,2-N,3-trimethylbutane-1,2-diamine with MolForge

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Related Compounds

N-(2-cyclopropylpropyl)-2,2-dimethylcyclopentan-1-amine
CID 115713968
4-[(2,2-dimethylcyclopentyl)amino]-3-methylbutan-1-ol
CID 79856763
1-N-cyclohexyl-2-N,2-N,3-trimethylbutane-1,2-diamine
CID 43205547
2,2-dimethyl-N-(2-methylbutyl)cyclohexan-1-amine
CID 79836799
2,2-dimethyl-N-[3-methyl-2-(4-methylpiperazin-1-yl)butyl]cyclopentan-1-amine
CID 79860281
2,2-dimethyl-N-(3-methyl-2-phenylbutyl)cyclopentan-1-amine
CID 107876254
N'-butan-2-yl-N-(2,2-dimethylcyclopentyl)-N'-methylethane-1,2-diamine
CID 115716401
1-[(2,2-dimethylcyclopentyl)amino]-3-(1-methoxypropan-2-yloxy)propan-2-ol
CID 106990157
N-ethyl-2,2-dimethylcyclopentan-1-amine;hydrochloride
CID 154577104
N-(cyclooctylmethyl)-2,2-dimethylcyclopentan-1-amine
CID 114207760
2-N,2-N,3-trimethyl-1-N-(2-methylcyclohexyl)butane-1,2-diamine
CID 43205442
2-N,2-N,3-trimethyl-1-N-(4-methylcyclohexyl)butane-1,2-diamine
CID 43205434

Frequently Asked Questions

What is the IUPAC name of 1-N-(2,2-dimethylcyclopentyl)-2-N,2-N,3-trimethylbutane-1,2-diamine?
The IUPAC name of 1-N-(2,2-dimethylcyclopentyl)-2-N,2-N,3-trimethylbutane-1,2-diamine (CID 79864207) is 1-N-(2,2-dimethylcyclopentyl)-2-N,2-N,3-trimethylbutane-1,2-diamine.
What is the SMILES notation for 1-N-(2,2-dimethylcyclopentyl)-2-N,2-N,3-trimethylbutane-1,2-diamine?
The canonical SMILES for 1-N-(2,2-dimethylcyclopentyl)-2-N,2-N,3-trimethylbutane-1,2-diamine is CC(C)C(CNC1CCCC1(C)C)N(C)C.
What is the InChIKey of 1-N-(2,2-dimethylcyclopentyl)-2-N,2-N,3-trimethylbutane-1,2-diamine?
The InChIKey is VOPBJZNHQSBQRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30N2/c1-11(2)12(16(5)6)10-15-13-8-7-9-14(13,3)4/h11-13,15H,7-10H2,1-6H3.
What are the key properties of 1-N-(2,2-dimethylcyclopentyl)-2-N,2-N,3-trimethylbutane-1,2-diamine?
1-N-(2,2-dimethylcyclopentyl)-2-N,2-N,3-trimethylbutane-1,2-diamine has a molecular weight of 226.41 g/mol, XLogP of 2.74, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N-(2,2-dimethylcyclopentyl)-2-N,2-N,3-trimethylbutane-1,2-diamine is sourced from PubChem (CID 79864207), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).