(Z)-N-(3-methyliminoprop-1-enyl)pent-2-en-2-amine

C9H16N2 — CID 174008947

IUPAC(Z)-N-(3-methyliminoprop-1-enyl)pent-2-en-2-amine
SMILESCC/C=C(/C)NC=C/C=N/C
InChIInChI=1S/C9H16N2/c1-4-6-9(2)11-8-5-7-10-3/h5-8,11H,4H2,1-3H3/b8-5?,9-6-,10-7+
InChIKeyFHFYVBXQEPGEOY-ORPCVAAJSA-N
MW152.24 g/mol
LogP2.10
Rot. Bonds4

About (Z)-N-(3-methyliminoprop-1-enyl)pent-2-en-2-amine

(Z)-N-(3-methyliminoprop-1-enyl)pent-2-en-2-amine (PubChem CID 174008947) has the molecular formula C9H16N2 and a molecular weight of 152.24 g/mol. Its IUPAC name is (Z)-N-(3-methyliminoprop-1-enyl)pent-2-en-2-amine.

Molecular Properties

Compound Name(Z)-N-(3-methyliminoprop-1-enyl)pent-2-en-2-amine
PubChem CID174008947
Molecular FormulaC9H16N2
Molecular Weight152.24 g/mol
Exact Mass152.13
IUPAC Name(Z)-N-(3-methyliminoprop-1-enyl)pent-2-en-2-amine
SMILESCC/C=C(/C)NC=C/C=N/C
InChIInChI=1S/C9H16N2/c1-4-6-9(2)11-8-5-7-10-3/h5-8,11H,4H2,1-3H3/b8-5?,9-6-,10-7+
InChIKeyFHFYVBXQEPGEOY-ORPCVAAJSA-N
XLogP2.10
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.24
LogP ≤ 52.10
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

(Z)-3-methyl-3-[(Z)-3-methyliminoprop-1-enyl]hept-4-en-2-one
CID 156741442
N,3-dimethylbut-2-en-1-imine;propane
CID 163403492
[(E)-pent-2-en-2-yl]urea
CID 71773699
(Z)-N-methyl-4-methyliminobut-2-en-1-amine
CID 147531560
N-[(E)-pent-2-en-2-yl]propan-1-imine
CID 147192367
N-[(Z)-3-methyliminoprop-1-enyl]methanimidamide
CID 176534291
2-[[(E)-pent-2-en-2-yl]amino]acetic acid
CID 155297764
(Z)-N-(1-chloropropyl)pent-2-en-2-amine
CID 155005340
4-methylidene-N-[(Z)-3-methyliminoprop-1-enyl]hexan-3-imine
CID 123252466
(3E,5Z)-N-[(1E,3Z)-4,5-dimethylhexa-1,3,5-trienyl]-6,7-dimethylocta-3,5-dien-4-amine
CID 138528062
4-(2-fluoropropan-2-yl)-N-[(2Z,4Z)-3-methyl-1-methyliminohepta-2,4-dien-4-yl]aniline
CID 169204948
methane;N-methyl-7-methyliminohepta-1,3,5-trien-1-amine
CID 158738891

Frequently Asked Questions

What is the IUPAC name of (Z)-N-(3-methyliminoprop-1-enyl)pent-2-en-2-amine?
The IUPAC name of (Z)-N-(3-methyliminoprop-1-enyl)pent-2-en-2-amine (CID 174008947) is (Z)-N-(3-methyliminoprop-1-enyl)pent-2-en-2-amine.
What is the SMILES notation for (Z)-N-(3-methyliminoprop-1-enyl)pent-2-en-2-amine?
The canonical SMILES for (Z)-N-(3-methyliminoprop-1-enyl)pent-2-en-2-amine is CC/C=C(/C)NC=C/C=N/C.
What is the InChIKey of (Z)-N-(3-methyliminoprop-1-enyl)pent-2-en-2-amine?
The InChIKey is FHFYVBXQEPGEOY-ORPCVAAJSA-N. The full InChI is InChI=1S/C9H16N2/c1-4-6-9(2)11-8-5-7-10-3/h5-8,11H,4H2,1-3H3/b8-5?,9-6-,10-7+.
What are the key properties of (Z)-N-(3-methyliminoprop-1-enyl)pent-2-en-2-amine?
(Z)-N-(3-methyliminoprop-1-enyl)pent-2-en-2-amine has a molecular weight of 152.24 g/mol, XLogP of 2.10, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-N-(3-methyliminoprop-1-enyl)pent-2-en-2-amine is sourced from PubChem (CID 174008947), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).