N-[(Z)-4-methylhex-2-enylidene]prop-2-enimidamide

C10H16N2 — CID 163954288

IUPACN-[(Z)-4-methylhex-2-enylidene]prop-2-enimidamide
SMILES[H]/N=C(C=C)/N=C\C=C/C(C)CC
InChIInChI=1S/C10H16N2/c1-4-9(3)7-6-8-12-10(11)5-2/h5-9,11H,2,4H2,1,3H3/b7-6-,11-10+,12-8+
InChIKeySBZOSRBJSPGQAH-BGMHDLRMSA-N
MW164.25 g/mol
LogP2.82
Rot. Bonds4

About N-[(Z)-4-methylhex-2-enylidene]prop-2-enimidamide

N-[(Z)-4-methylhex-2-enylidene]prop-2-enimidamide (PubChem CID 163954288) has the molecular formula C10H16N2 and a molecular weight of 164.25 g/mol. Its IUPAC name is N-[(Z)-4-methylhex-2-enylidene]prop-2-enimidamide.

Molecular Properties

Compound NameN-[(Z)-4-methylhex-2-enylidene]prop-2-enimidamide
PubChem CID163954288
Molecular FormulaC10H16N2
Molecular Weight164.25 g/mol
Exact Mass164.13
IUPAC NameN-[(Z)-4-methylhex-2-enylidene]prop-2-enimidamide
SMILES[H]/N=C(C=C)/N=C\C=C/C(C)CC
InChIInChI=1S/C10H16N2/c1-4-9(3)7-6-8-12-10(11)5-2/h5-9,11H,2,4H2,1,3H3/b7-6-,11-10+,12-8+
InChIKeySBZOSRBJSPGQAH-BGMHDLRMSA-N
XLogP2.82
TPSA36.21 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.25
LogP ≤ 52.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-[(Z)-4-methylhex-2-enylidene]prop-2-enimidamide?
The IUPAC name of N-[(Z)-4-methylhex-2-enylidene]prop-2-enimidamide (CID 163954288) is N-[(Z)-4-methylhex-2-enylidene]prop-2-enimidamide.
What is the SMILES notation for N-[(Z)-4-methylhex-2-enylidene]prop-2-enimidamide?
The canonical SMILES for N-[(Z)-4-methylhex-2-enylidene]prop-2-enimidamide is [H]/N=C(C=C)/N=C\C=C/C(C)CC.
What is the InChIKey of N-[(Z)-4-methylhex-2-enylidene]prop-2-enimidamide?
The InChIKey is SBZOSRBJSPGQAH-BGMHDLRMSA-N. The full InChI is InChI=1S/C10H16N2/c1-4-9(3)7-6-8-12-10(11)5-2/h5-9,11H,2,4H2,1,3H3/b7-6-,11-10+,12-8+.
What are the key properties of N-[(Z)-4-methylhex-2-enylidene]prop-2-enimidamide?
N-[(Z)-4-methylhex-2-enylidene]prop-2-enimidamide has a molecular weight of 164.25 g/mol, XLogP of 2.82, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(Z)-4-methylhex-2-enylidene]prop-2-enimidamide is sourced from PubChem (CID 163954288), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).