(25Z)-N,N-dimethylhentriaconta-22,25-dien-10-amine

C33H65N — CID 175715549

IUPAC(25Z)-N,N-dimethylhentriaconta-22,25-dien-10-amine
SMILESCCCCC/C=C\CC=CCCCCCCCCCCCC(CCCCCCCCC)N(C)C
InChIInChI=1S/C33H65N/c1-5-7-9-11-13-14-15-16-17-18-19-20-21-22-23-24-26-28-30-32-33(34(3)4)31-29-27-25-12-10-8-6-2/h13-14,16-17,33H,5-12,15,18-32H2,1-4H3/b14-13-,17-16?
InChIKeyFVHCEZRYPCZLAX-SXFBVRDISA-N
MW475.89 g/mol
LogP11.43
Rot. Bonds27

About (25Z)-N,N-dimethylhentriaconta-22,25-dien-10-amine

(25Z)-N,N-dimethylhentriaconta-22,25-dien-10-amine (PubChem CID 175715549) has the molecular formula C33H65N and a molecular weight of 475.89 g/mol. Its IUPAC name is (25Z)-N,N-dimethylhentriaconta-22,25-dien-10-amine.

Molecular Properties

Compound Name(25Z)-N,N-dimethylhentriaconta-22,25-dien-10-amine
PubChem CID175715549
Molecular FormulaC33H65N
Molecular Weight475.89 g/mol
Exact Mass475.51
IUPAC Name(25Z)-N,N-dimethylhentriaconta-22,25-dien-10-amine
SMILESCCCCC/C=C\CC=CCCCCCCCCCCCC(CCCCCCCCC)N(C)C
InChIInChI=1S/C33H65N/c1-5-7-9-11-13-14-15-16-17-18-19-20-21-22-23-24-26-28-30-32-33(34(3)4)31-29-27-25-12-10-8-6-2/h13-14,16-17,33H,5-12,15,18-32H2,1-4H3/b14-13-,17-16?
InChIKeyFVHCEZRYPCZLAX-SXFBVRDISA-N
XLogP11.43
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds27
Heavy Atoms34
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500475.89
LogP ≤ 511.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze (25Z)-N,N-dimethylhentriaconta-22,25-dien-10-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

(18E,21E)-N,N-dimethylheptacosa-18,21-dien-10-amine
CID 87170077
(12Z,15Z)-N,N-dimethylhenicosa-12,15-dien-4-amine
CID 56944147
N,N-dimethyltetracos-17-en-9-amine
CID 123150200
(Z)-N,N-dimethyltetratriacont-25-en-17-amine
CID 87229276
(Z,10R)-N,N-dimethylnonacos-17-en-10-amine
CID 126711357
N,N-dimethyldotriacont-24-en-10-amine
CID 175230423
(20Z,23Z)-N-ethyl-N-methylnonacosa-20,23-dien-10-amine
CID 56944347
(2S)-N,N-dimethyl-1-octadeca-9,12-dienoxydecan-2-amine
CID 123232356
(2S)-N,N-dimethyl-1-octadeca-9,12-dienoxydodecan-2-amine
CID 123185025
(6Z,9Z,28Z,31Z)-N-methyl-N-[(9Z,12Z)-octadeca-9,12-dienyl]heptatriaconta-6,9,28,31-tetraen-19-amine
CID 134205277
(10R)-N,N-dimethylheptacosan-10-amine
CID 134549801
N,N-dimethyltetracontan-19-amine
CID 45382230

Frequently Asked Questions

What is the IUPAC name of (25Z)-N,N-dimethylhentriaconta-22,25-dien-10-amine?
The IUPAC name of (25Z)-N,N-dimethylhentriaconta-22,25-dien-10-amine (CID 175715549) is (25Z)-N,N-dimethylhentriaconta-22,25-dien-10-amine.
What is the SMILES notation for (25Z)-N,N-dimethylhentriaconta-22,25-dien-10-amine?
The canonical SMILES for (25Z)-N,N-dimethylhentriaconta-22,25-dien-10-amine is CCCCC/C=C\CC=CCCCCCCCCCCCC(CCCCCCCCC)N(C)C.
What is the InChIKey of (25Z)-N,N-dimethylhentriaconta-22,25-dien-10-amine?
The InChIKey is FVHCEZRYPCZLAX-SXFBVRDISA-N. The full InChI is InChI=1S/C33H65N/c1-5-7-9-11-13-14-15-16-17-18-19-20-21-22-23-24-26-28-30-32-33(34(3)4)31-29-27-25-12-10-8-6-2/h13-14,16-17,33H,5-12,15,18-32H2,1-4H3/b14-13-,17-16?.
What are the key properties of (25Z)-N,N-dimethylhentriaconta-22,25-dien-10-amine?
(25Z)-N,N-dimethylhentriaconta-22,25-dien-10-amine has a molecular weight of 475.89 g/mol, XLogP of 11.43, 27 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (25Z)-N,N-dimethylhentriaconta-22,25-dien-10-amine is sourced from PubChem (CID 175715549), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).