(Z)-3-cyclopentylimino-2-ethyl-4-methylpent-1-en-1-amine;methane

C14H28N2 — CID 171505830

IUPAC(Z)-3-cyclopentylimino-2-ethyl-4-methylpent-1-en-1-amine;methane
SMILESC.CCC(=C/N)/C(=N/C1CCCC1)C(C)C
InChIInChI=1S/C13H24N2.CH4/c1-4-11(9-14)13(10(2)3)15-12-7-5-6-8-12;/h9-10,12H,4-8,14H2,1-3H3;1H4/b11-9-,15-13+;
InChIKeyPVSJQNNTIRHSKO-GELVFLTDSA-N
MW224.39 g/mol
LogP3.91
Rot. Bonds4

About (Z)-3-cyclopentylimino-2-ethyl-4-methylpent-1-en-1-amine;methane

(Z)-3-cyclopentylimino-2-ethyl-4-methylpent-1-en-1-amine;methane (PubChem CID 171505830) has the molecular formula C14H28N2 and a molecular weight of 224.39 g/mol. Its IUPAC name is (Z)-3-cyclopentylimino-2-ethyl-4-methylpent-1-en-1-amine;methane.

Molecular Properties

Compound Name(Z)-3-cyclopentylimino-2-ethyl-4-methylpent-1-en-1-amine;methane
PubChem CID171505830
Molecular FormulaC14H28N2
Molecular Weight224.39 g/mol
Exact Mass224.23
IUPAC Name(Z)-3-cyclopentylimino-2-ethyl-4-methylpent-1-en-1-amine;methane
SMILESC.CCC(=C/N)/C(=N/C1CCCC1)C(C)C
InChIInChI=1S/C13H24N2.CH4/c1-4-11(9-14)13(10(2)3)15-12-7-5-6-8-12;/h9-10,12H,4-8,14H2,1-3H3;1H4/b11-9-,15-13+;
InChIKeyPVSJQNNTIRHSKO-GELVFLTDSA-N
XLogP3.91
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.39
LogP ≤ 53.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

3,5-dimethyl-4-[(E)-3,3,3-trifluoro-2-methylprop-1-enyl]iminohex-5-en-2-amine
CID 163897078
(Z)-2-(C,N-dimethylcarbonimidoyl)-3-methylbut-1-en-1-amine
CID 89209473
(Z)-2,4-dimethyl-3-propan-2-yliminopent-1-en-1-amine
CID 131996296
(Z)-2-(3,4-dihydro-2H-pyrrol-5-yl)prop-1-en-1-amine
CID 142624858
3-Ethyl-5-(2-methylprop-1-enylimino)hept-6-ene-1,4-diamine
CID 144799384
3-Cyclopentylimino-2-methylpenta-1,4-dien-1-amine
CID 148725137
3-Cyclopentylimino-2-ethylpenta-1,4-dien-1-amine
CID 152978176
2-(C,N-dimethylcarbonimidoyl)-3-methylbut-1-en-1-amine
CID 153146948
(Z)-2-(3-ethyl-2,3,4,5-tetrahydropyridin-6-yl)but-1-en-1-amine;propane
CID 153571613
(Z)-3-hexan-3-ylimino-2,4-dimethylpent-1-en-1-amine
CID 171505896
(Z)-3-(cyclobutylmethylimino)-2,4-dimethylpent-1-en-1-amine
CID 171506070
(Z)-2,4-dimethyl-3-(3-methylheptan-3-ylimino)pent-1-en-1-amine
CID 171506297

Frequently Asked Questions

What is the IUPAC name of (Z)-3-cyclopentylimino-2-ethyl-4-methylpent-1-en-1-amine;methane?
The IUPAC name of (Z)-3-cyclopentylimino-2-ethyl-4-methylpent-1-en-1-amine;methane (CID 171505830) is (Z)-3-cyclopentylimino-2-ethyl-4-methylpent-1-en-1-amine;methane.
What is the SMILES notation for (Z)-3-cyclopentylimino-2-ethyl-4-methylpent-1-en-1-amine;methane?
The canonical SMILES for (Z)-3-cyclopentylimino-2-ethyl-4-methylpent-1-en-1-amine;methane is C.CCC(=C/N)/C(=N/C1CCCC1)C(C)C.
What is the InChIKey of (Z)-3-cyclopentylimino-2-ethyl-4-methylpent-1-en-1-amine;methane?
The InChIKey is PVSJQNNTIRHSKO-GELVFLTDSA-N. The full InChI is InChI=1S/C13H24N2.CH4/c1-4-11(9-14)13(10(2)3)15-12-7-5-6-8-12;/h9-10,12H,4-8,14H2,1-3H3;1H4/b11-9-,15-13+;.
What are the key properties of (Z)-3-cyclopentylimino-2-ethyl-4-methylpent-1-en-1-amine;methane?
(Z)-3-cyclopentylimino-2-ethyl-4-methylpent-1-en-1-amine;methane has a molecular weight of 224.39 g/mol, XLogP of 3.91, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-3-cyclopentylimino-2-ethyl-4-methylpent-1-en-1-amine;methane is sourced from PubChem (CID 171505830), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).