(Z)-2-N-(cyclopropylmethyl)-4-N-methylidenebut-3-ene-2,4-diimine

C9H14N2 — CID 165132341

IUPAC(Z)-2-N-(cyclopropylmethyl)-4-N-methylidenebut-3-ene-2,4-diimine
SMILESC=N/C=C\C(C)=N\CC1CC1
InChIInChI=1S/C9H14N2/c1-8(5-6-10-2)11-7-9-3-4-9/h5-6,9H,2-4,7H2,1H3/b6-5-,11-8+
InChIKeyKNRVNFCOTVLOOU-ZLQDEDOTSA-N
MW150.22 g/mol
LogP2.07
Rot. Bonds4

About (Z)-2-N-(cyclopropylmethyl)-4-N-methylidenebut-3-ene-2,4-diimine

(Z)-2-N-(cyclopropylmethyl)-4-N-methylidenebut-3-ene-2,4-diimine (PubChem CID 165132341) has the molecular formula C9H14N2 and a molecular weight of 150.22 g/mol. Its IUPAC name is (Z)-2-N-(cyclopropylmethyl)-4-N-methylidenebut-3-ene-2,4-diimine.

Molecular Properties

Compound Name(Z)-2-N-(cyclopropylmethyl)-4-N-methylidenebut-3-ene-2,4-diimine
PubChem CID165132341
Molecular FormulaC9H14N2
Molecular Weight150.22 g/mol
Exact Mass150.12
IUPAC Name(Z)-2-N-(cyclopropylmethyl)-4-N-methylidenebut-3-ene-2,4-diimine
SMILESC=N/C=C\C(C)=N\CC1CC1
InChIInChI=1S/C9H14N2/c1-8(5-6-10-2)11-7-9-3-4-9/h5-6,9H,2-4,7H2,1H3/b6-5-,11-8+
InChIKeyKNRVNFCOTVLOOU-ZLQDEDOTSA-N
XLogP2.07
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.22
LogP ≤ 52.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

(Z)-2-N-methyl-4-N-methylidenebut-3-ene-2,4-diimine
CID 88585998
N-(cyclopropylmethyl)but-3-en-2-imine
CID 123524921
2-N-ethyl-4-N-methylidenebut-3-ene-2,4-diimine
CID 123646959
2-N-methyl-4-N-methylidenebut-3-ene-2,4-diimine
CID 123934598
(Z)-2-N-ethyl-4-N-methylidenebut-3-ene-2,4-diimine
CID 146350910
(Z)-3-N,4-dimethyl-1-N-methylidenepent-1-ene-1,3-diimine
CID 147043195
N-[(Z)-2-(methylideneamino)ethenyl]but-3-en-2-imine
CID 155053467

Frequently Asked Questions

What is the IUPAC name of (Z)-2-N-(cyclopropylmethyl)-4-N-methylidenebut-3-ene-2,4-diimine?
The IUPAC name of (Z)-2-N-(cyclopropylmethyl)-4-N-methylidenebut-3-ene-2,4-diimine (CID 165132341) is (Z)-2-N-(cyclopropylmethyl)-4-N-methylidenebut-3-ene-2,4-diimine.
What is the SMILES notation for (Z)-2-N-(cyclopropylmethyl)-4-N-methylidenebut-3-ene-2,4-diimine?
The canonical SMILES for (Z)-2-N-(cyclopropylmethyl)-4-N-methylidenebut-3-ene-2,4-diimine is C=N/C=C\C(C)=N\CC1CC1.
What is the InChIKey of (Z)-2-N-(cyclopropylmethyl)-4-N-methylidenebut-3-ene-2,4-diimine?
The InChIKey is KNRVNFCOTVLOOU-ZLQDEDOTSA-N. The full InChI is InChI=1S/C9H14N2/c1-8(5-6-10-2)11-7-9-3-4-9/h5-6,9H,2-4,7H2,1H3/b6-5-,11-8+.
What are the key properties of (Z)-2-N-(cyclopropylmethyl)-4-N-methylidenebut-3-ene-2,4-diimine?
(Z)-2-N-(cyclopropylmethyl)-4-N-methylidenebut-3-ene-2,4-diimine has a molecular weight of 150.22 g/mol, XLogP of 2.07, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-2-N-(cyclopropylmethyl)-4-N-methylidenebut-3-ene-2,4-diimine is sourced from PubChem (CID 165132341), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).