(Z)-N-methyl-1-(propan-2-ylideneamino)prop-1-en-2-amine

C7H14N2 — CID 89138569

IUPAC(Z)-N-methyl-1-(propan-2-ylideneamino)prop-1-en-2-amine
SMILESCN/C(C)=C\N=C(C)C
InChIInChI=1S/C7H14N2/c1-6(2)9-5-7(3)8-4/h5,8H,1-4H3/b7-5-
InChIKeyARNMVSIQEBHIGV-ALCCZGGFSA-N
MW126.20 g/mol
LogP1.55
Rot. Bonds2

About (Z)-N-methyl-1-(propan-2-ylideneamino)prop-1-en-2-amine

(Z)-N-methyl-1-(propan-2-ylideneamino)prop-1-en-2-amine (PubChem CID 89138569) has the molecular formula C7H14N2 and a molecular weight of 126.20 g/mol. Its IUPAC name is (Z)-N-methyl-1-(propan-2-ylideneamino)prop-1-en-2-amine.

Molecular Properties

Compound Name(Z)-N-methyl-1-(propan-2-ylideneamino)prop-1-en-2-amine
PubChem CID89138569
Molecular FormulaC7H14N2
Molecular Weight126.20 g/mol
Exact Mass126.12
IUPAC Name(Z)-N-methyl-1-(propan-2-ylideneamino)prop-1-en-2-amine
SMILESCN/C(C)=C\N=C(C)C
InChIInChI=1S/C7H14N2/c1-6(2)9-5-7(3)8-4/h5,8H,1-4H3/b7-5-
InChIKeyARNMVSIQEBHIGV-ALCCZGGFSA-N
XLogP1.55
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500126.20
LogP ≤ 51.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (Z)-N-methyl-1-(propan-2-ylideneamino)prop-1-en-2-amine?
The IUPAC name of (Z)-N-methyl-1-(propan-2-ylideneamino)prop-1-en-2-amine (CID 89138569) is (Z)-N-methyl-1-(propan-2-ylideneamino)prop-1-en-2-amine.
What is the SMILES notation for (Z)-N-methyl-1-(propan-2-ylideneamino)prop-1-en-2-amine?
The canonical SMILES for (Z)-N-methyl-1-(propan-2-ylideneamino)prop-1-en-2-amine is CN/C(C)=C\N=C(C)C.
What is the InChIKey of (Z)-N-methyl-1-(propan-2-ylideneamino)prop-1-en-2-amine?
The InChIKey is ARNMVSIQEBHIGV-ALCCZGGFSA-N. The full InChI is InChI=1S/C7H14N2/c1-6(2)9-5-7(3)8-4/h5,8H,1-4H3/b7-5-.
What are the key properties of (Z)-N-methyl-1-(propan-2-ylideneamino)prop-1-en-2-amine?
(Z)-N-methyl-1-(propan-2-ylideneamino)prop-1-en-2-amine has a molecular weight of 126.20 g/mol, XLogP of 1.55, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-N-methyl-1-(propan-2-ylideneamino)prop-1-en-2-amine is sourced from PubChem (CID 89138569), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).