N-methyl-1-[2-(2-methylpropyl)cyclopentyl]methanamine

C11H23N — CID 81033789

IUPACN-methyl-1-[2-(2-methylpropyl)cyclopentyl]methanamine
SMILESCNCC1CCCC1CC(C)C
InChIInChI=1S/C11H23N/c1-9(2)7-10-5-4-6-11(10)8-12-3/h9-12H,4-8H2,1-3H3
InChIKeyBPELZHVRKPAUAT-UHFFFAOYSA-N
MW169.31 g/mol
LogP2.67
Rot. Bonds4

About N-methyl-1-[2-(2-methylpropyl)cyclopentyl]methanamine

N-methyl-1-[2-(2-methylpropyl)cyclopentyl]methanamine (PubChem CID 81033789) has the molecular formula C11H23N and a molecular weight of 169.31 g/mol. Its IUPAC name is N-methyl-1-[2-(2-methylpropyl)cyclopentyl]methanamine.

Molecular Properties

Compound NameN-methyl-1-[2-(2-methylpropyl)cyclopentyl]methanamine
PubChem CID81033789
Molecular FormulaC11H23N
Molecular Weight169.31 g/mol
Exact Mass169.18
IUPAC NameN-methyl-1-[2-(2-methylpropyl)cyclopentyl]methanamine
SMILESCNCC1CCCC1CC(C)C
InChIInChI=1S/C11H23N/c1-9(2)7-10-5-4-6-11(10)8-12-3/h9-12H,4-8H2,1-3H3
InChIKeyBPELZHVRKPAUAT-UHFFFAOYSA-N
XLogP2.67
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.31
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-methyl-1-[2-(2-methylpropyl)cyclopentyl]methanamine?
The IUPAC name of N-methyl-1-[2-(2-methylpropyl)cyclopentyl]methanamine (CID 81033789) is N-methyl-1-[2-(2-methylpropyl)cyclopentyl]methanamine.
What is the SMILES notation for N-methyl-1-[2-(2-methylpropyl)cyclopentyl]methanamine?
The canonical SMILES for N-methyl-1-[2-(2-methylpropyl)cyclopentyl]methanamine is CNCC1CCCC1CC(C)C.
What is the InChIKey of N-methyl-1-[2-(2-methylpropyl)cyclopentyl]methanamine?
The InChIKey is BPELZHVRKPAUAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N/c1-9(2)7-10-5-4-6-11(10)8-12-3/h9-12H,4-8H2,1-3H3.
What are the key properties of N-methyl-1-[2-(2-methylpropyl)cyclopentyl]methanamine?
N-methyl-1-[2-(2-methylpropyl)cyclopentyl]methanamine has a molecular weight of 169.31 g/mol, XLogP of 2.67, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-[2-(2-methylpropyl)cyclopentyl]methanamine is sourced from PubChem (CID 81033789), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).