(Z)-2-iminopent-3-en-1-amine

C5H10N2 — CID 123316218

IUPAC(Z)-2-iminopent-3-en-1-amine
SMILES[H]/N=C(/C=C\C)CN
InChIInChI=1S/C5H10N2/c1-2-3-5(7)4-6/h2-3,7H,4,6H2,1H3/b3-2-,7-5-
InChIKeyOBDSRHYCNSUQQX-ZSBGFAJOSA-N
MW98.15 g/mol
LogP0.54
Rot. Bonds2

About (Z)-2-iminopent-3-en-1-amine

(Z)-2-iminopent-3-en-1-amine (PubChem CID 123316218) has the molecular formula C5H10N2 and a molecular weight of 98.15 g/mol. Its IUPAC name is (Z)-2-iminopent-3-en-1-amine.

Molecular Properties

Compound Name(Z)-2-iminopent-3-en-1-amine
PubChem CID123316218
Molecular FormulaC5H10N2
Molecular Weight98.15 g/mol
Exact Mass98.08
IUPAC Name(Z)-2-iminopent-3-en-1-amine
SMILES[H]/N=C(/C=C\C)CN
InChIInChI=1S/C5H10N2/c1-2-3-5(7)4-6/h2-3,7H,4,6H2,1H3/b3-2-,7-5-
InChIKeyOBDSRHYCNSUQQX-ZSBGFAJOSA-N
XLogP0.54
TPSA49.87 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50098.15
LogP ≤ 50.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

4-Iminocyclohexa-2,5-dien-1-amine
CID 140108
(3-Fluoro-2,3-dihydropyridin-6-yl)methanamine
CID 91464248
(Z)-2-ethylimino-5-fluorohex-3-en-1-amine
CID 143075712
(Z)-pent-2-ene-1,4-diimine
CID 59089718
2H-pyrrol-5-ylmethanamine
CID 67991228
2,3-Dihydropyridin-6-ylmethanamine
CID 70426662
(Z)-hex-2-ene-1,4-diimine
CID 88171021
(Z)-2-iminopent-3-ene-1,4-diamine
CID 89129435
(Z)-5-N-methylhex-3-ene-2,5-diimine
CID 89591069
(Z)-4-N-methylpent-2-ene-1,4-diimine
CID 90308470
(Z)-pent-3-en-2-imine
CID 90707502
(4Z)-hepta-1,4-dien-3-imine
CID 90857061

Frequently Asked Questions

What is the IUPAC name of (Z)-2-iminopent-3-en-1-amine?
The IUPAC name of (Z)-2-iminopent-3-en-1-amine (CID 123316218) is (Z)-2-iminopent-3-en-1-amine.
What is the SMILES notation for (Z)-2-iminopent-3-en-1-amine?
The canonical SMILES for (Z)-2-iminopent-3-en-1-amine is [H]/N=C(/C=C\C)CN.
What is the InChIKey of (Z)-2-iminopent-3-en-1-amine?
The InChIKey is OBDSRHYCNSUQQX-ZSBGFAJOSA-N. The full InChI is InChI=1S/C5H10N2/c1-2-3-5(7)4-6/h2-3,7H,4,6H2,1H3/b3-2-,7-5-.
What are the key properties of (Z)-2-iminopent-3-en-1-amine?
(Z)-2-iminopent-3-en-1-amine has a molecular weight of 98.15 g/mol, XLogP of 0.54, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-2-iminopent-3-en-1-amine is sourced from PubChem (CID 123316218), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).