(2,4-dimethylcyclopentyl)methanamine

C8H17N — CID 134314260

IUPAC(2,4-dimethylcyclopentyl)methanamine
SMILESCC1CC(C)C(CN)C1
InChIInChI=1S/C8H17N/c1-6-3-7(2)8(4-6)5-9/h6-8H,3-5,9H2,1-2H3
InChIKeyLWOARSDKIIMNCG-UHFFFAOYSA-N
MW127.23 g/mol
LogP1.63
Rot. Bonds1

About (2,4-dimethylcyclopentyl)methanamine

(2,4-dimethylcyclopentyl)methanamine (PubChem CID 134314260) has the molecular formula C8H17N and a molecular weight of 127.23 g/mol. Its IUPAC name is (2,4-dimethylcyclopentyl)methanamine.

Molecular Properties

Compound Name(2,4-dimethylcyclopentyl)methanamine
PubChem CID134314260
Molecular FormulaC8H17N
Molecular Weight127.23 g/mol
Exact Mass127.14
IUPAC Name(2,4-dimethylcyclopentyl)methanamine
SMILESCC1CC(C)C(CN)C1
InChIInChI=1S/C8H17N/c1-6-3-7(2)8(4-6)5-9/h6-8H,3-5,9H2,1-2H3
InChIKeyLWOARSDKIIMNCG-UHFFFAOYSA-N
XLogP1.63
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500127.23
LogP ≤ 51.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (2,4-dimethylcyclopentyl)methanamine?
The IUPAC name of (2,4-dimethylcyclopentyl)methanamine (CID 134314260) is (2,4-dimethylcyclopentyl)methanamine.
What is the SMILES notation for (2,4-dimethylcyclopentyl)methanamine?
The canonical SMILES for (2,4-dimethylcyclopentyl)methanamine is CC1CC(C)C(CN)C1.
What is the InChIKey of (2,4-dimethylcyclopentyl)methanamine?
The InChIKey is LWOARSDKIIMNCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17N/c1-6-3-7(2)8(4-6)5-9/h6-8H,3-5,9H2,1-2H3.
What are the key properties of (2,4-dimethylcyclopentyl)methanamine?
(2,4-dimethylcyclopentyl)methanamine has a molecular weight of 127.23 g/mol, XLogP of 1.63, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2,4-dimethylcyclopentyl)methanamine is sourced from PubChem (CID 134314260), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).