(Z)-3-(3-propyldec-1-en-2-ylimino)prop-1-en-1-amine

C16H30N2 — CID 130434045

IUPAC(Z)-3-(3-propyldec-1-en-2-ylimino)prop-1-en-1-amine
SMILESC=C(/N=C/C=C\N)C(CCC)CCCCCCC
InChIInChI=1S/C16H30N2/c1-4-6-7-8-9-12-16(11-5-2)15(3)18-14-10-13-17/h10,13-14,16H,3-9,11-12,17H2,1-2H3/b13-10-,18-14+
InChIKeyTVCSWGCZHPWQOJ-JBFGZICXSA-N
MW250.43 g/mol
LogP4.82
Rot. Bonds11

About (Z)-3-(3-propyldec-1-en-2-ylimino)prop-1-en-1-amine

(Z)-3-(3-propyldec-1-en-2-ylimino)prop-1-en-1-amine (PubChem CID 130434045) has the molecular formula C16H30N2 and a molecular weight of 250.43 g/mol. Its IUPAC name is (Z)-3-(3-propyldec-1-en-2-ylimino)prop-1-en-1-amine.

Molecular Properties

Compound Name(Z)-3-(3-propyldec-1-en-2-ylimino)prop-1-en-1-amine
PubChem CID130434045
Molecular FormulaC16H30N2
Molecular Weight250.43 g/mol
Exact Mass250.24
IUPAC Name(Z)-3-(3-propyldec-1-en-2-ylimino)prop-1-en-1-amine
SMILESC=C(/N=C/C=C\N)C(CCC)CCCCCCC
InChIInChI=1S/C16H30N2/c1-4-6-7-8-9-12-16(11-5-2)15(3)18-14-10-13-17/h10,13-14,16H,3-9,11-12,17H2,1-2H3/b13-10-,18-14+
InChIKeyTVCSWGCZHPWQOJ-JBFGZICXSA-N
XLogP4.82
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds11
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.43
LogP ≤ 54.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (Z)-3-(3-propyldec-1-en-2-ylimino)prop-1-en-1-amine?
The IUPAC name of (Z)-3-(3-propyldec-1-en-2-ylimino)prop-1-en-1-amine (CID 130434045) is (Z)-3-(3-propyldec-1-en-2-ylimino)prop-1-en-1-amine.
What is the SMILES notation for (Z)-3-(3-propyldec-1-en-2-ylimino)prop-1-en-1-amine?
The canonical SMILES for (Z)-3-(3-propyldec-1-en-2-ylimino)prop-1-en-1-amine is C=C(/N=C/C=C\N)C(CCC)CCCCCCC.
What is the InChIKey of (Z)-3-(3-propyldec-1-en-2-ylimino)prop-1-en-1-amine?
The InChIKey is TVCSWGCZHPWQOJ-JBFGZICXSA-N. The full InChI is InChI=1S/C16H30N2/c1-4-6-7-8-9-12-16(11-5-2)15(3)18-14-10-13-17/h10,13-14,16H,3-9,11-12,17H2,1-2H3/b13-10-,18-14+.
What are the key properties of (Z)-3-(3-propyldec-1-en-2-ylimino)prop-1-en-1-amine?
(Z)-3-(3-propyldec-1-en-2-ylimino)prop-1-en-1-amine has a molecular weight of 250.43 g/mol, XLogP of 4.82, 11 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-3-(3-propyldec-1-en-2-ylimino)prop-1-en-1-amine is sourced from PubChem (CID 130434045), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).