(Z)-N-methyl-N-prop-2-enylnonadec-10-en-1-amine

C23H45N — CID 174909012

IUPAC(Z)-N-methyl-N-prop-2-enylnonadec-10-en-1-amine
SMILESC=CCN(C)CCCCCCCCC/C=C\CCCCCCCC
InChIInChI=1S/C23H45N/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-23-24(3)22-5-2/h5,12-13H,2,4,6-11,14-23H2,1,3H3/b13-12-
InChIKeyVYJRFHSKUONKSX-SEYXRHQNSA-N
MW335.62 g/mol
LogP7.53
Rot. Bonds19

About (Z)-N-methyl-N-prop-2-enylnonadec-10-en-1-amine

(Z)-N-methyl-N-prop-2-enylnonadec-10-en-1-amine (PubChem CID 174909012) has the molecular formula C23H45N and a molecular weight of 335.62 g/mol. Its IUPAC name is (Z)-N-methyl-N-prop-2-enylnonadec-10-en-1-amine.

Molecular Properties

Compound Name(Z)-N-methyl-N-prop-2-enylnonadec-10-en-1-amine
PubChem CID174909012
Molecular FormulaC23H45N
Molecular Weight335.62 g/mol
Exact Mass335.36
IUPAC Name(Z)-N-methyl-N-prop-2-enylnonadec-10-en-1-amine
SMILESC=CCN(C)CCCCCCCCC/C=C\CCCCCCCC
InChIInChI=1S/C23H45N/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-23-24(3)22-5-2/h5,12-13H,2,4,6-11,14-23H2,1,3H3/b13-12-
InChIKeyVYJRFHSKUONKSX-SEYXRHQNSA-N
XLogP7.53
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds19
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500335.62
LogP ≤ 57.53
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'}

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Related Compounds

N-methyl-N-prop-2-enylhexadecan-1-amine
CID 100953658
N-methyl-N-prop-2-enyloctadecan-1-amine;hydrochloride
CID 173181442
N,N,N'-trimethyl-N'-[(Z)-octadec-9-enyl]propane-1,3-diamine
CID 6437658
(E)-N,N-dimethylhexadec-10-en-1-amine
CID 102116363
(Z)-N,N-dimethylhenicos-12-en-1-amine
CID 173308130
N,N-dimethylhexadec-7-en-1-amine
CID 3085374
triaconta-1,19-diene
CID 54007897
pentacosa-1,9,15-triene
CID 90876289
tetradeca-1,8-diene
CID 90913546
pentacosa-1,16-diene
CID 57082437
pentaconta-1,25-diene
CID 90941740
heptadeca-1,7-diene
CID 57204265

Frequently Asked Questions

What is the IUPAC name of (Z)-N-methyl-N-prop-2-enylnonadec-10-en-1-amine?
The IUPAC name of (Z)-N-methyl-N-prop-2-enylnonadec-10-en-1-amine (CID 174909012) is (Z)-N-methyl-N-prop-2-enylnonadec-10-en-1-amine.
What is the SMILES notation for (Z)-N-methyl-N-prop-2-enylnonadec-10-en-1-amine?
The canonical SMILES for (Z)-N-methyl-N-prop-2-enylnonadec-10-en-1-amine is C=CCN(C)CCCCCCCCC/C=C\CCCCCCCC.
What is the InChIKey of (Z)-N-methyl-N-prop-2-enylnonadec-10-en-1-amine?
The InChIKey is VYJRFHSKUONKSX-SEYXRHQNSA-N. The full InChI is InChI=1S/C23H45N/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-23-24(3)22-5-2/h5,12-13H,2,4,6-11,14-23H2,1,3H3/b13-12-.
What are the key properties of (Z)-N-methyl-N-prop-2-enylnonadec-10-en-1-amine?
(Z)-N-methyl-N-prop-2-enylnonadec-10-en-1-amine has a molecular weight of 335.62 g/mol, XLogP of 7.53, 19 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-N-methyl-N-prop-2-enylnonadec-10-en-1-amine is sourced from PubChem (CID 174909012), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).