(1Z,3Z)-N-ethyl-1-(methylideneamino)-N-propylpenta-1,3-dien-1-amine

C11H20N2 — CID 153372800

IUPAC(1Z,3Z)-N-ethyl-1-(methylideneamino)-N-propylpenta-1,3-dien-1-amine
SMILESC=N/C(=C\C=C/C)N(CC)CCC
InChIInChI=1S/C11H20N2/c1-5-8-9-11(12-4)13(7-3)10-6-2/h5,8-9H,4,6-7,10H2,1-3H3/b8-5-,11-9+
InChIKeyMATXXRMMIPLBQA-TWGJSUAUSA-N
MW180.29 g/mol
LogP2.84
Rot. Bonds6

About (1Z,3Z)-N-ethyl-1-(methylideneamino)-N-propylpenta-1,3-dien-1-amine

(1Z,3Z)-N-ethyl-1-(methylideneamino)-N-propylpenta-1,3-dien-1-amine (PubChem CID 153372800) has the molecular formula C11H20N2 and a molecular weight of 180.29 g/mol. Its IUPAC name is (1Z,3Z)-N-ethyl-1-(methylideneamino)-N-propylpenta-1,3-dien-1-amine.

Molecular Properties

Compound Name(1Z,3Z)-N-ethyl-1-(methylideneamino)-N-propylpenta-1,3-dien-1-amine
PubChem CID153372800
Molecular FormulaC11H20N2
Molecular Weight180.29 g/mol
Exact Mass180.16
IUPAC Name(1Z,3Z)-N-ethyl-1-(methylideneamino)-N-propylpenta-1,3-dien-1-amine
SMILESC=N/C(=C\C=C/C)N(CC)CCC
InChIInChI=1S/C11H20N2/c1-5-8-9-11(12-4)13(7-3)10-6-2/h5,8-9H,4,6-7,10H2,1-3H3/b8-5-,11-9+
InChIKeyMATXXRMMIPLBQA-TWGJSUAUSA-N
XLogP2.84
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.29
LogP ≤ 52.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze (1Z,3Z)-N-ethyl-1-(methylideneamino)-N-propylpenta-1,3-dien-1-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

(1E)-N-ethyl-2-fluoro-1-(methylideneamino)-N-propylbuta-1,3-dien-1-amine
CID 145614067
1-methyl-N,N-dipropyl-2H-pyridin-6-amine
CID 56612432
N-(1-propyl-2H-pyridin-6-yl)methanimine
CID 67094195
N-(1-ethyl-2H-pyridin-6-yl)methanimine
CID 68517921
N-(1-prop-2-enyl-2H-pyridin-6-yl)methanimine
CID 69239175
N,N-dimethyl-1-(methylideneamino)penta-1,3-dien-1-amine
CID 123871731
(Z)-N-methyl-N-[1-(methylideneamino)ethyl]but-2-en-2-amine
CID 139472691
(1Z)-N-methyl-1-(methylideneamino)-N-propan-2-ylbuta-1,3-dien-1-amine
CID 142451889
N,N-dipropyl-1-azacyclohepta-2,3,5,7-tetraen-2-amine
CID 144149916
N-[(1Z,3Z)-1-piperidin-1-ylpenta-1,3-dienyl]methanimine
CID 144281614
N-[(1Z,3Z)-1-(4-methylpiperazin-1-yl)penta-1,3-dienyl]methanimine
CID 144895565
ethane;(1Z,3Z)-N-ethyl-1-(methylideneamino)-N-propylpenta-1,3-dien-1-amine
CID 153372799

Frequently Asked Questions

What is the IUPAC name of (1Z,3Z)-N-ethyl-1-(methylideneamino)-N-propylpenta-1,3-dien-1-amine?
The IUPAC name of (1Z,3Z)-N-ethyl-1-(methylideneamino)-N-propylpenta-1,3-dien-1-amine (CID 153372800) is (1Z,3Z)-N-ethyl-1-(methylideneamino)-N-propylpenta-1,3-dien-1-amine.
What is the SMILES notation for (1Z,3Z)-N-ethyl-1-(methylideneamino)-N-propylpenta-1,3-dien-1-amine?
The canonical SMILES for (1Z,3Z)-N-ethyl-1-(methylideneamino)-N-propylpenta-1,3-dien-1-amine is C=N/C(=C\C=C/C)N(CC)CCC.
What is the InChIKey of (1Z,3Z)-N-ethyl-1-(methylideneamino)-N-propylpenta-1,3-dien-1-amine?
The InChIKey is MATXXRMMIPLBQA-TWGJSUAUSA-N. The full InChI is InChI=1S/C11H20N2/c1-5-8-9-11(12-4)13(7-3)10-6-2/h5,8-9H,4,6-7,10H2,1-3H3/b8-5-,11-9+.
What are the key properties of (1Z,3Z)-N-ethyl-1-(methylideneamino)-N-propylpenta-1,3-dien-1-amine?
(1Z,3Z)-N-ethyl-1-(methylideneamino)-N-propylpenta-1,3-dien-1-amine has a molecular weight of 180.29 g/mol, XLogP of 2.84, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1Z,3Z)-N-ethyl-1-(methylideneamino)-N-propylpenta-1,3-dien-1-amine is sourced from PubChem (CID 153372800), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).