(Z)-3-imino-1-piperidin-4-ylprop-1-en-1-amine

C8H15N3 — CID 142802804

IUPAC(Z)-3-imino-1-piperidin-4-ylprop-1-en-1-amine
SMILES[H]/N=C/C=C(\N)C1CCNCC1
InChIInChI=1S/C8H15N3/c9-4-1-8(10)7-2-5-11-6-3-7/h1,4,7,9,11H,2-3,5-6,10H2/b8-1-,9-4+
InChIKeyQKCPDWONSMJEAS-BCAYKNBBSA-N
MW153.23 g/mol
LogP0.48
Rot. Bonds2

About (Z)-3-imino-1-piperidin-4-ylprop-1-en-1-amine

(Z)-3-imino-1-piperidin-4-ylprop-1-en-1-amine (PubChem CID 142802804) has the molecular formula C8H15N3 and a molecular weight of 153.23 g/mol. Its IUPAC name is (Z)-3-imino-1-piperidin-4-ylprop-1-en-1-amine.

Molecular Properties

Compound Name(Z)-3-imino-1-piperidin-4-ylprop-1-en-1-amine
PubChem CID142802804
Molecular FormulaC8H15N3
Molecular Weight153.23 g/mol
Exact Mass153.13
IUPAC Name(Z)-3-imino-1-piperidin-4-ylprop-1-en-1-amine
SMILES[H]/N=C/C=C(\N)C1CCNCC1
InChIInChI=1S/C8H15N3/c9-4-1-8(10)7-2-5-11-6-3-7/h1,4,7,9,11H,2-3,5-6,10H2/b8-1-,9-4+
InChIKeyQKCPDWONSMJEAS-BCAYKNBBSA-N
XLogP0.48
TPSA61.90 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.23
LogP ≤ 50.48
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

Hexahydro-1,6-naphthyridine
CID 142921049
1,6-Naphthyridine-d8
CID 129654637
4-(3H-pyrrol-5-ylmethyl)piperidine
CID 54520917
2-Piperidin-4-ylpyrrol-2-amine
CID 57461956
1,2,3,4,4a,5-Hexahydro-2,7-phenanthroline
CID 68774632
6-Methyl-3-piperidin-4-yl-3,4-dihydropyridine
CID 69355119
6-Piperidin-3-yl-3,4-dihydropyridine
CID 90103419
N-[(E)-3-piperidin-4-ylprop-2-enylidene]methanimidamide
CID 90453379
1,2,3,4,4a,5-Hexahydro-2,6-naphthyridine
CID 90698342
(E)-3-(2,6-dimethylidenepiperidin-3-yl)prop-2-en-1-imine
CID 132135316
(Z)-N-(1-piperidin-3-ylethenyl)but-2-en-1-imine
CID 134527720
(Z)-1-piperidin-4-yl-N-prop-1-en-2-ylprop-1-en-1-amine
CID 142187220

Frequently Asked Questions

What is the IUPAC name of (Z)-3-imino-1-piperidin-4-ylprop-1-en-1-amine?
The IUPAC name of (Z)-3-imino-1-piperidin-4-ylprop-1-en-1-amine (CID 142802804) is (Z)-3-imino-1-piperidin-4-ylprop-1-en-1-amine.
What is the SMILES notation for (Z)-3-imino-1-piperidin-4-ylprop-1-en-1-amine?
The canonical SMILES for (Z)-3-imino-1-piperidin-4-ylprop-1-en-1-amine is [H]/N=C/C=C(\N)C1CCNCC1.
What is the InChIKey of (Z)-3-imino-1-piperidin-4-ylprop-1-en-1-amine?
The InChIKey is QKCPDWONSMJEAS-BCAYKNBBSA-N. The full InChI is InChI=1S/C8H15N3/c9-4-1-8(10)7-2-5-11-6-3-7/h1,4,7,9,11H,2-3,5-6,10H2/b8-1-,9-4+.
What are the key properties of (Z)-3-imino-1-piperidin-4-ylprop-1-en-1-amine?
(Z)-3-imino-1-piperidin-4-ylprop-1-en-1-amine has a molecular weight of 153.23 g/mol, XLogP of 0.48, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-3-imino-1-piperidin-4-ylprop-1-en-1-amine is sourced from PubChem (CID 142802804), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).