2-(cyclopentylmethyl)-2,3-dimethylbutan-1-amine

C12H25N — CID 83159555

IUPAC2-(cyclopentylmethyl)-2,3-dimethylbutan-1-amine
SMILESCC(C)C(C)(CN)CC1CCCC1
InChIInChI=1S/C12H25N/c1-10(2)12(3,9-13)8-11-6-4-5-7-11/h10-11H,4-9,13H2,1-3H3
InChIKeyGYYRCIPADSDIQQ-UHFFFAOYSA-N
MW183.34 g/mol
LogP3.19
Rot. Bonds4

About 2-(cyclopentylmethyl)-2,3-dimethylbutan-1-amine

2-(cyclopentylmethyl)-2,3-dimethylbutan-1-amine (PubChem CID 83159555) has the molecular formula C12H25N and a molecular weight of 183.34 g/mol. Its IUPAC name is 2-(cyclopentylmethyl)-2,3-dimethylbutan-1-amine.

Molecular Properties

Compound Name2-(cyclopentylmethyl)-2,3-dimethylbutan-1-amine
PubChem CID83159555
Molecular FormulaC12H25N
Molecular Weight183.34 g/mol
Exact Mass183.20
IUPAC Name2-(cyclopentylmethyl)-2,3-dimethylbutan-1-amine
SMILESCC(C)C(C)(CN)CC1CCCC1
InChIInChI=1S/C12H25N/c1-10(2)12(3,9-13)8-11-6-4-5-7-11/h10-11H,4-9,13H2,1-3H3
InChIKeyGYYRCIPADSDIQQ-UHFFFAOYSA-N
XLogP3.19
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.34
LogP ≤ 53.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-(cyclopentylmethyl)-2,3-dimethylbutan-1-amine?
The IUPAC name of 2-(cyclopentylmethyl)-2,3-dimethylbutan-1-amine (CID 83159555) is 2-(cyclopentylmethyl)-2,3-dimethylbutan-1-amine.
What is the SMILES notation for 2-(cyclopentylmethyl)-2,3-dimethylbutan-1-amine?
The canonical SMILES for 2-(cyclopentylmethyl)-2,3-dimethylbutan-1-amine is CC(C)C(C)(CN)CC1CCCC1.
What is the InChIKey of 2-(cyclopentylmethyl)-2,3-dimethylbutan-1-amine?
The InChIKey is GYYRCIPADSDIQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25N/c1-10(2)12(3,9-13)8-11-6-4-5-7-11/h10-11H,4-9,13H2,1-3H3.
What are the key properties of 2-(cyclopentylmethyl)-2,3-dimethylbutan-1-amine?
2-(cyclopentylmethyl)-2,3-dimethylbutan-1-amine has a molecular weight of 183.34 g/mol, XLogP of 3.19, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopentylmethyl)-2,3-dimethylbutan-1-amine is sourced from PubChem (CID 83159555), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).