4-methyltetradecan-5-amine

C15H33N — CID 115831509

IUPAC4-methyltetradecan-5-amine
SMILESCCCCCCCCCC(N)C(C)CCC
InChIInChI=1S/C15H33N/c1-4-6-7-8-9-10-11-13-15(16)14(3)12-5-2/h14-15H,4-13,16H2,1-3H3
InChIKeyBLAZHHDVIBBWOL-UHFFFAOYSA-N
MW227.44 g/mol
LogP4.89
Rot. Bonds11

About 4-methyltetradecan-5-amine

4-methyltetradecan-5-amine (PubChem CID 115831509) has the molecular formula C15H33N and a molecular weight of 227.44 g/mol. Its IUPAC name is 4-methyltetradecan-5-amine.

Molecular Properties

Compound Name4-methyltetradecan-5-amine
PubChem CID115831509
Molecular FormulaC15H33N
Molecular Weight227.44 g/mol
Exact Mass227.26
IUPAC Name4-methyltetradecan-5-amine
SMILESCCCCCCCCCC(N)C(C)CCC
InChIInChI=1S/C15H33N/c1-4-6-7-8-9-10-11-13-15(16)14(3)12-5-2/h14-15H,4-13,16H2,1-3H3
InChIKeyBLAZHHDVIBBWOL-UHFFFAOYSA-N
XLogP4.89
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds11
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.44
LogP ≤ 54.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 4-methyltetradecan-5-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

3-methyldecan-4-amine
CID 63719252
hexadecane-4,5-diamine
CID 57310882
hexadecane-6,7-diamine
CID 57245820
tritriacontane-16,17-diamine
CID 57106039
hexatriacontane-18,19-diamine
CID 57054547
4-methylundecan-3-amine
CID 63562083
(3R)-2-methylundecan-3-amine
CID 167260316
4,5-dimethylnonadecane
CID 123321090
(4R)-tridecan-4-amine
CID 150614684
pentacosan-7-amine
CID 88938409
nonapentacontan-30-amine
CID 118952570
(2S,3S)-2-amino-3-methylicosan-1-ol
CID 118700758

Frequently Asked Questions

What is the IUPAC name of 4-methyltetradecan-5-amine?
The IUPAC name of 4-methyltetradecan-5-amine (CID 115831509) is 4-methyltetradecan-5-amine.
What is the SMILES notation for 4-methyltetradecan-5-amine?
The canonical SMILES for 4-methyltetradecan-5-amine is CCCCCCCCCC(N)C(C)CCC.
What is the InChIKey of 4-methyltetradecan-5-amine?
The InChIKey is BLAZHHDVIBBWOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H33N/c1-4-6-7-8-9-10-11-13-15(16)14(3)12-5-2/h14-15H,4-13,16H2,1-3H3.
What are the key properties of 4-methyltetradecan-5-amine?
4-methyltetradecan-5-amine has a molecular weight of 227.44 g/mol, XLogP of 4.89, 11 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyltetradecan-5-amine is sourced from PubChem (CID 115831509), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).