(Z)-4-imino-3-piperidin-3-ylpent-2-en-2-amine

C10H19N3 — CID 139358573

IUPAC(Z)-4-imino-3-piperidin-3-ylpent-2-en-2-amine
SMILES[H]/N=C(C)/C(=C(/C)N)C1CCCNC1
InChIInChI=1S/C10H19N3/c1-7(11)10(8(2)12)9-4-3-5-13-6-9/h9,11,13H,3-6,12H2,1-2H3/b10-8+,11-7+
InChIKeyDWYUMCOHUBJLGF-VTTRTIMMSA-N
MW181.28 g/mol
LogP1.26
Rot. Bonds2

About (Z)-4-imino-3-piperidin-3-ylpent-2-en-2-amine

(Z)-4-imino-3-piperidin-3-ylpent-2-en-2-amine (PubChem CID 139358573) has the molecular formula C10H19N3 and a molecular weight of 181.28 g/mol. Its IUPAC name is (Z)-4-imino-3-piperidin-3-ylpent-2-en-2-amine.

Molecular Properties

Compound Name(Z)-4-imino-3-piperidin-3-ylpent-2-en-2-amine
PubChem CID139358573
Molecular FormulaC10H19N3
Molecular Weight181.28 g/mol
Exact Mass181.16
IUPAC Name(Z)-4-imino-3-piperidin-3-ylpent-2-en-2-amine
SMILES[H]/N=C(C)/C(=C(/C)N)C1CCCNC1
InChIInChI=1S/C10H19N3/c1-7(11)10(8(2)12)9-4-3-5-13-6-9/h9,11,13H,3-6,12H2,1-2H3/b10-8+,11-7+
InChIKeyDWYUMCOHUBJLGF-VTTRTIMMSA-N
XLogP1.26
TPSA61.90 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.28
LogP ≤ 51.26
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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)-4-imino-3-piperidin-3-ylpent-2-en-2-amine?
The IUPAC name of (Z)-4-imino-3-piperidin-3-ylpent-2-en-2-amine (CID 139358573) is (Z)-4-imino-3-piperidin-3-ylpent-2-en-2-amine.
What is the SMILES notation for (Z)-4-imino-3-piperidin-3-ylpent-2-en-2-amine?
The canonical SMILES for (Z)-4-imino-3-piperidin-3-ylpent-2-en-2-amine is [H]/N=C(C)/C(=C(/C)N)C1CCCNC1.
What is the InChIKey of (Z)-4-imino-3-piperidin-3-ylpent-2-en-2-amine?
The InChIKey is DWYUMCOHUBJLGF-VTTRTIMMSA-N. The full InChI is InChI=1S/C10H19N3/c1-7(11)10(8(2)12)9-4-3-5-13-6-9/h9,11,13H,3-6,12H2,1-2H3/b10-8+,11-7+.
What are the key properties of (Z)-4-imino-3-piperidin-3-ylpent-2-en-2-amine?
(Z)-4-imino-3-piperidin-3-ylpent-2-en-2-amine has a molecular weight of 181.28 g/mol, XLogP of 1.26, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-4-imino-3-piperidin-3-ylpent-2-en-2-amine is sourced from PubChem (CID 139358573), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).