4-methylpentan-2-amine

C6H15N — CID 7908

IUPAC4-methylpentan-2-amine
SMILESCC(C)CC(C)N
InChIInChI=1S/C6H15N/c1-5(2)4-6(3)7/h5-6H,4,7H2,1-3H3
InChIKeyUNBMPKNTYKDYCG-UHFFFAOYSA-N
MW101.19 g/mol
LogP1.38
Rot. Bonds2

About 4-methylpentan-2-amine

4-methylpentan-2-amine (PubChem CID 7908) has the molecular formula C6H15N and a molecular weight of 101.19 g/mol. Its IUPAC name is 4-methylpentan-2-amine.

Molecular Properties

Compound Name4-methylpentan-2-amine
PubChem CID7908
Molecular FormulaC6H15N
Molecular Weight101.19 g/mol
Exact Mass101.12
IUPAC Name4-methylpentan-2-amine
SMILESCC(C)CC(C)N
InChIInChI=1S/C6H15N/c1-5(2)4-6(3)7/h5-6H,4,7H2,1-3H3
InChIKeyUNBMPKNTYKDYCG-UHFFFAOYSA-N
XLogP1.38
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500101.19
LogP ≤ 51.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1,3-Dimethylamylamine
CID 7753
1,2-Dimethylpropylamine
CID 11731
5-Methyl-2-hexylamine
CID 34204
2-Ethyl butylamine
CID 12049
Isohexylamine
CID 219608
3-Pentanamine, 2,4-dimethyl-
CID 77702
(2R)-4-methylpentan-2-amine
CID 642324
1-Pentanamine, 2-methyl-
CID 99014
3-Methyl-2-hexanamine
CID 118232
1,2-Dimethylpropylamine, (R)-
CID 6999786
1-Cyclopropylethanamine
CID 519239
(2S)-4-methylpentan-2-amine
CID 6994058

Frequently Asked Questions

What is the IUPAC name of 4-methylpentan-2-amine?
The IUPAC name of 4-methylpentan-2-amine (CID 7908) is 4-methylpentan-2-amine.
What is the SMILES notation for 4-methylpentan-2-amine?
The canonical SMILES for 4-methylpentan-2-amine is CC(C)CC(C)N.
What is the InChIKey of 4-methylpentan-2-amine?
The InChIKey is UNBMPKNTYKDYCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H15N/c1-5(2)4-6(3)7/h5-6H,4,7H2,1-3H3.
What are the key properties of 4-methylpentan-2-amine?
4-methylpentan-2-amine has a molecular weight of 101.19 g/mol, XLogP of 1.38, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methylpentan-2-amine is sourced from PubChem (CID 7908), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).