(Z,2E)-2-ethylidene-N-[(E)-hex-2-en-3-yl]-N,3-dimethylpent-3-en-1-amine

C15H27N — CID 139542208

IUPAC(Z,2E)-2-ethylidene-N-[(E)-hex-2-en-3-yl]-N,3-dimethylpent-3-en-1-amine
SMILESC/C=C(C)\C(=C/C)CN(C)/C(=C/C)CCC
InChIInChI=1S/C15H27N/c1-7-11-15(10-4)16(6)12-14(9-3)13(5)8-2/h8-10H,7,11-12H2,1-6H3/b13-8-,14-9-,15-10+
InChIKeyVRMXKZXNYWCTHF-PGACUVGTSA-N
MW221.39 g/mol
LogP4.53
Rot. Bonds6

About (Z,2E)-2-ethylidene-N-[(E)-hex-2-en-3-yl]-N,3-dimethylpent-3-en-1-amine

(Z,2E)-2-ethylidene-N-[(E)-hex-2-en-3-yl]-N,3-dimethylpent-3-en-1-amine (PubChem CID 139542208) has the molecular formula C15H27N and a molecular weight of 221.39 g/mol. Its IUPAC name is (Z,2E)-2-ethylidene-N-[(E)-hex-2-en-3-yl]-N,3-dimethylpent-3-en-1-amine.

Molecular Properties

Compound Name(Z,2E)-2-ethylidene-N-[(E)-hex-2-en-3-yl]-N,3-dimethylpent-3-en-1-amine
PubChem CID139542208
Molecular FormulaC15H27N
Molecular Weight221.39 g/mol
Exact Mass221.21
IUPAC Name(Z,2E)-2-ethylidene-N-[(E)-hex-2-en-3-yl]-N,3-dimethylpent-3-en-1-amine
SMILESC/C=C(C)\C(=C/C)CN(C)/C(=C/C)CCC
InChIInChI=1S/C15H27N/c1-7-11-15(10-4)16(6)12-14(9-3)13(5)8-2/h8-10H,7,11-12H2,1-6H3/b13-8-,14-9-,15-10+
InChIKeyVRMXKZXNYWCTHF-PGACUVGTSA-N
XLogP4.53
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.39
LogP ≤ 54.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (Z,2E)-2-ethylidene-N-[(E)-hex-2-en-3-yl]-N,3-dimethylpent-3-en-1-amine?
The IUPAC name of (Z,2E)-2-ethylidene-N-[(E)-hex-2-en-3-yl]-N,3-dimethylpent-3-en-1-amine (CID 139542208) is (Z,2E)-2-ethylidene-N-[(E)-hex-2-en-3-yl]-N,3-dimethylpent-3-en-1-amine.
What is the SMILES notation for (Z,2E)-2-ethylidene-N-[(E)-hex-2-en-3-yl]-N,3-dimethylpent-3-en-1-amine?
The canonical SMILES for (Z,2E)-2-ethylidene-N-[(E)-hex-2-en-3-yl]-N,3-dimethylpent-3-en-1-amine is C/C=C(C)\C(=C/C)CN(C)/C(=C/C)CCC.
What is the InChIKey of (Z,2E)-2-ethylidene-N-[(E)-hex-2-en-3-yl]-N,3-dimethylpent-3-en-1-amine?
The InChIKey is VRMXKZXNYWCTHF-PGACUVGTSA-N. The full InChI is InChI=1S/C15H27N/c1-7-11-15(10-4)16(6)12-14(9-3)13(5)8-2/h8-10H,7,11-12H2,1-6H3/b13-8-,14-9-,15-10+.
What are the key properties of (Z,2E)-2-ethylidene-N-[(E)-hex-2-en-3-yl]-N,3-dimethylpent-3-en-1-amine?
(Z,2E)-2-ethylidene-N-[(E)-hex-2-en-3-yl]-N,3-dimethylpent-3-en-1-amine has a molecular weight of 221.39 g/mol, XLogP of 4.53, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z,2E)-2-ethylidene-N-[(E)-hex-2-en-3-yl]-N,3-dimethylpent-3-en-1-amine is sourced from PubChem (CID 139542208), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).