(10Z)-N-undec-10-enylnonadeca-1,10-dien-2-amine

C30H57N — CID 143317568

IUPAC(10Z)-N-undec-10-enylnonadeca-1,10-dien-2-amine
SMILESC=CCCCCCCCCCNC(=C)CCCCCCC/C=C\CCCCCCCC
InChIInChI=1S/C30H57N/c1-4-6-8-10-12-14-15-16-17-18-19-20-22-24-26-28-30(3)31-29-27-25-23-21-13-11-9-7-5-2/h5,16-17,31H,2-4,6-15,18-29H2,1H3/b17-16-
InChIKeyXKNUJOCHMPXYKF-MSUUIHNZSA-N
MW431.79 g/mol
LogP10.43
Rot. Bonds26

About (10Z)-N-undec-10-enylnonadeca-1,10-dien-2-amine

(10Z)-N-undec-10-enylnonadeca-1,10-dien-2-amine (PubChem CID 143317568) has the molecular formula C30H57N and a molecular weight of 431.79 g/mol. Its IUPAC name is (10Z)-N-undec-10-enylnonadeca-1,10-dien-2-amine.

Molecular Properties

Compound Name(10Z)-N-undec-10-enylnonadeca-1,10-dien-2-amine
PubChem CID143317568
Molecular FormulaC30H57N
Molecular Weight431.79 g/mol
Exact Mass431.45
IUPAC Name(10Z)-N-undec-10-enylnonadeca-1,10-dien-2-amine
SMILESC=CCCCCCCCCCNC(=C)CCCCCCC/C=C\CCCCCCCC
InChIInChI=1S/C30H57N/c1-4-6-8-10-12-14-15-16-17-18-19-20-22-24-26-28-30(3)31-29-27-25-23-21-13-11-9-7-5-2/h5,16-17,31H,2-4,6-15,18-29H2,1H3/b17-16-
InChIKeyXKNUJOCHMPXYKF-MSUUIHNZSA-N
XLogP10.43
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds26
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500431.79
LogP ≤ 510.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

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CID 6435904
(Z)-N1-(Octadec-9-en-1-yl)propane-1,3-diamine xhydrochloride
CID 88836539
Dioleylamine
CID 11214516
2-Hexenyl-5-nonyl-pyrrolidine
CID 57202270
(Z)-N-(3-Aminopropyl)-N'-9-octadecenylpropane-1,3-diamine
CID 6438215
2-Hexenyl-5-nonyl-pyrroline
CID 129866570
2-Hex-1-enyl-5-nonylidenepyrrolidine
CID 163192432
N-(Octadec-9-en-1-yl)octadec-9-en-1-amine
CID 162408
(Z)-N-(3-aminopropyl)-N'-[3-(9-octadecenylamino)propyl]propane-1,3-diamine
CID 20836174
2-methyl-6-[(E)-pentadec-6-enyl]piperidine
CID 5458392
2-Hexenyl-5-heptyl pyrrolidine
CID 57136831
2-Methyl-6-(cis-4-tridecenyl)piperidine
CID 68549441

Frequently Asked Questions

What is the IUPAC name of (10Z)-N-undec-10-enylnonadeca-1,10-dien-2-amine?
The IUPAC name of (10Z)-N-undec-10-enylnonadeca-1,10-dien-2-amine (CID 143317568) is (10Z)-N-undec-10-enylnonadeca-1,10-dien-2-amine.
What is the SMILES notation for (10Z)-N-undec-10-enylnonadeca-1,10-dien-2-amine?
The canonical SMILES for (10Z)-N-undec-10-enylnonadeca-1,10-dien-2-amine is C=CCCCCCCCCCNC(=C)CCCCCCC/C=C\CCCCCCCC.
What is the InChIKey of (10Z)-N-undec-10-enylnonadeca-1,10-dien-2-amine?
The InChIKey is XKNUJOCHMPXYKF-MSUUIHNZSA-N. The full InChI is InChI=1S/C30H57N/c1-4-6-8-10-12-14-15-16-17-18-19-20-22-24-26-28-30(3)31-29-27-25-23-21-13-11-9-7-5-2/h5,16-17,31H,2-4,6-15,18-29H2,1H3/b17-16-.
What are the key properties of (10Z)-N-undec-10-enylnonadeca-1,10-dien-2-amine?
(10Z)-N-undec-10-enylnonadeca-1,10-dien-2-amine has a molecular weight of 431.79 g/mol, XLogP of 10.43, 26 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (10Z)-N-undec-10-enylnonadeca-1,10-dien-2-amine is sourced from PubChem (CID 143317568), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).