(2S)-tetradecan-2-amine

C14H31N — CID 25021238

IUPAC(2S)-tetradecan-2-amine
SMILESCCCCCCCCCCCC[C@H](C)N
InChIInChI=1S/C14H31N/c1-3-4-5-6-7-8-9-10-11-12-13-14(2)15/h14H,3-13,15H2,1-2H3/t14-/m0/s1
InChIKeyRRLSSXNOPYHNQL-AWEZNQCLSA-N
MW213.41 g/mol
LogP4.64
Rot. Bonds11

About (2S)-tetradecan-2-amine

(2S)-tetradecan-2-amine (PubChem CID 25021238) has the molecular formula C14H31N and a molecular weight of 213.41 g/mol. Its IUPAC name is (2S)-tetradecan-2-amine.

Molecular Properties

Compound Name(2S)-tetradecan-2-amine
PubChem CID25021238
Molecular FormulaC14H31N
Molecular Weight213.41 g/mol
Exact Mass213.25
IUPAC Name(2S)-tetradecan-2-amine
SMILESCCCCCCCCCCCC[C@H](C)N
InChIInChI=1S/C14H31N/c1-3-4-5-6-7-8-9-10-11-12-13-14(2)15/h14H,3-13,15H2,1-2H3/t14-/m0/s1
InChIKeyRRLSSXNOPYHNQL-AWEZNQCLSA-N
XLogP4.64
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds11
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.41
LogP ≤ 54.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

(2S)-tridecan-2-amine
CID 24884182
(2S)-nonadecan-2-amine
CID 94864909
tetradecan-2-amine;hydrobromide
CID 175070931
dodecan-2-amine;hydrochloride
CID 86195878
nonadecane-2,14-diamine
CID 89095951
dodecan-1-amine;dodecan-2-amine
CID 88815564
6-methylnonadecan-2-amine
CID 54497673
docosane-2,21-diamine
CID 150079956
9-methoxypentadecan-2-amine
CID 89335213
carbamic acid;undecan-2-amine
CID 175209089
propanoic acid;tetradecan-2-amine
CID 173174901
11,11-difluorooctadecan-2-amine
CID 150665400

Frequently Asked Questions

What is the IUPAC name of (2S)-tetradecan-2-amine?
The IUPAC name of (2S)-tetradecan-2-amine (CID 25021238) is (2S)-tetradecan-2-amine.
What is the SMILES notation for (2S)-tetradecan-2-amine?
The canonical SMILES for (2S)-tetradecan-2-amine is CCCCCCCCCCCC[C@H](C)N.
What is the InChIKey of (2S)-tetradecan-2-amine?
The InChIKey is RRLSSXNOPYHNQL-AWEZNQCLSA-N. The full InChI is InChI=1S/C14H31N/c1-3-4-5-6-7-8-9-10-11-12-13-14(2)15/h14H,3-13,15H2,1-2H3/t14-/m0/s1.
What are the key properties of (2S)-tetradecan-2-amine?
(2S)-tetradecan-2-amine has a molecular weight of 213.41 g/mol, XLogP of 4.64, 11 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-tetradecan-2-amine is sourced from PubChem (CID 25021238), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).