(Z)-2-(propylideneamino)prop-1-en-1-amine

C6H12N2 — CID 123385642

IUPAC(Z)-2-(propylideneamino)prop-1-en-1-amine
SMILESCC/C=N/C(C)=C\N
InChIInChI=1S/C6H12N2/c1-3-4-8-6(2)5-7/h4-5H,3,7H2,1-2H3/b6-5-,8-4+
InChIKeyMEVCBYFVKUJPSM-QNMAEOQASA-N
MW112.18 g/mol
LogP1.29
Rot. Bonds2

About (Z)-2-(propylideneamino)prop-1-en-1-amine

(Z)-2-(propylideneamino)prop-1-en-1-amine (PubChem CID 123385642) has the molecular formula C6H12N2 and a molecular weight of 112.18 g/mol. Its IUPAC name is (Z)-2-(propylideneamino)prop-1-en-1-amine.

Molecular Properties

Compound Name(Z)-2-(propylideneamino)prop-1-en-1-amine
PubChem CID123385642
Molecular FormulaC6H12N2
Molecular Weight112.18 g/mol
Exact Mass112.10
IUPAC Name(Z)-2-(propylideneamino)prop-1-en-1-amine
SMILESCC/C=N/C(C)=C\N
InChIInChI=1S/C6H12N2/c1-3-4-8-6(2)5-7/h4-5H,3,7H2,1-2H3/b6-5-,8-4+
InChIKeyMEVCBYFVKUJPSM-QNMAEOQASA-N
XLogP1.29
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500112.18
LogP ≤ 51.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2,5-Dimethyldihydropyrazine
CID 19926417
2,6-Dimethyldihydropyrazine
CID 129771674
(E)-2-fluoro-3-prop-1-en-2-yliminoprop-1-en-1-amine
CID 89209833
N-prop-1-en-2-ylpropan-1-imine
CID 13099163
2-Ethyl-5-methyl-1,2-dihydropyrazine
CID 20691937
5-Methyl-1,2-dihydropyrazine
CID 66607554
6-Methyl-1,2-dihydropyrazine
CID 68099554
2-methyl-6,7-dihydro-1H-1,4-diazepine
CID 68099668
3-methyl-6,7-dihydro-1H-1,4-diazepine
CID 68099669
(Z)-2-methyl-3-prop-1-en-2-yliminoprop-1-en-1-amine
CID 88056015
(Z)-3-prop-1-en-2-yliminoprop-1-en-1-amine
CID 88236263
(Z)-3-but-1-en-2-yliminoprop-1-en-1-amine
CID 88268688

Frequently Asked Questions

What is the IUPAC name of (Z)-2-(propylideneamino)prop-1-en-1-amine?
The IUPAC name of (Z)-2-(propylideneamino)prop-1-en-1-amine (CID 123385642) is (Z)-2-(propylideneamino)prop-1-en-1-amine.
What is the SMILES notation for (Z)-2-(propylideneamino)prop-1-en-1-amine?
The canonical SMILES for (Z)-2-(propylideneamino)prop-1-en-1-amine is CC/C=N/C(C)=C\N.
What is the InChIKey of (Z)-2-(propylideneamino)prop-1-en-1-amine?
The InChIKey is MEVCBYFVKUJPSM-QNMAEOQASA-N. The full InChI is InChI=1S/C6H12N2/c1-3-4-8-6(2)5-7/h4-5H,3,7H2,1-2H3/b6-5-,8-4+.
What are the key properties of (Z)-2-(propylideneamino)prop-1-en-1-amine?
(Z)-2-(propylideneamino)prop-1-en-1-amine has a molecular weight of 112.18 g/mol, XLogP of 1.29, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-2-(propylideneamino)prop-1-en-1-amine is sourced from PubChem (CID 123385642), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).