2-methyl-N-pentan-3-ylpentan-1-amine

C11H25N — CID 43204323

IUPAC2-methyl-N-pentan-3-ylpentan-1-amine
SMILESCCCC(C)CNC(CC)CC
InChIInChI=1S/C11H25N/c1-5-8-10(4)9-12-11(6-2)7-3/h10-12H,5-9H2,1-4H3
InChIKeyRVCZJOAHQBLEBE-UHFFFAOYSA-N
MW171.33 g/mol
LogP3.20
Rot. Bonds7

About 2-methyl-N-pentan-3-ylpentan-1-amine

2-methyl-N-pentan-3-ylpentan-1-amine (PubChem CID 43204323) has the molecular formula C11H25N and a molecular weight of 171.33 g/mol. Its IUPAC name is 2-methyl-N-pentan-3-ylpentan-1-amine.

Molecular Properties

Compound Name2-methyl-N-pentan-3-ylpentan-1-amine
PubChem CID43204323
Molecular FormulaC11H25N
Molecular Weight171.33 g/mol
Exact Mass171.20
IUPAC Name2-methyl-N-pentan-3-ylpentan-1-amine
SMILESCCCC(C)CNC(CC)CC
InChIInChI=1S/C11H25N/c1-5-8-10(4)9-12-11(6-2)7-3/h10-12H,5-9H2,1-4H3
InChIKeyRVCZJOAHQBLEBE-UHFFFAOYSA-N
XLogP3.20
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.33
LogP ≤ 53.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 2-methyl-N-pentan-3-ylpentan-1-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(2-methylpentylamino)propane-1,3-diol
CID 65315712
(2S)-2-methyl-N-propan-2-ylpentan-1-amine
CID 28610224
N,2-dimethyl-N'-pentan-3-ylpropane-1,3-diamine
CID 115303228
1-(2-methylpentylamino)ethanol
CID 88836184
4-methyl-2-(2-methylpentylamino)pentan-1-ol
CID 61245377
N-(1-chloropropan-2-yl)-2-methylpentan-1-amine
CID 65025793
N-[2-(2-methylpentoxy)ethyl]pentan-3-amine
CID 103285771
3-methyl-N-pentan-3-yl-2-propan-2-ylbutan-1-amine
CID 102904025
(2S)-3-methyl-2-(2-methylpentylamino)butan-1-ol
CID 79253780
4-methylheptane
CID 91413347
4-methylheptane
CID 11512
2-methyl-N-(1-methylsulfanylbutan-2-yl)butan-1-amine
CID 115899950

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-pentan-3-ylpentan-1-amine?
The IUPAC name of 2-methyl-N-pentan-3-ylpentan-1-amine (CID 43204323) is 2-methyl-N-pentan-3-ylpentan-1-amine.
What is the SMILES notation for 2-methyl-N-pentan-3-ylpentan-1-amine?
The canonical SMILES for 2-methyl-N-pentan-3-ylpentan-1-amine is CCCC(C)CNC(CC)CC.
What is the InChIKey of 2-methyl-N-pentan-3-ylpentan-1-amine?
The InChIKey is RVCZJOAHQBLEBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H25N/c1-5-8-10(4)9-12-11(6-2)7-3/h10-12H,5-9H2,1-4H3.
What are the key properties of 2-methyl-N-pentan-3-ylpentan-1-amine?
2-methyl-N-pentan-3-ylpentan-1-amine has a molecular weight of 171.33 g/mol, XLogP of 3.20, 7 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-pentan-3-ylpentan-1-amine is sourced from PubChem (CID 43204323), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).