(Z)-N-ethyl-N',3-dimethyl-N-[2-(methylamino)ethyl]pent-2-enimidamide

C12H25N3 — CID 142398174

IUPAC(Z)-N-ethyl-N',3-dimethyl-N-[2-(methylamino)ethyl]pent-2-enimidamide
SMILESCC/C(C)=C\C(=N/C)N(CC)CCNC
InChIInChI=1S/C12H25N3/c1-6-11(3)10-12(14-5)15(7-2)9-8-13-4/h10,13H,6-9H2,1-5H3/b11-10-,14-12+
InChIKeyXGWKUZILNMYQCV-HSINTONASA-N
MW211.35 g/mol
LogP1.91
Rot. Bonds6

About (Z)-N-ethyl-N',3-dimethyl-N-[2-(methylamino)ethyl]pent-2-enimidamide

(Z)-N-ethyl-N',3-dimethyl-N-[2-(methylamino)ethyl]pent-2-enimidamide (PubChem CID 142398174) has the molecular formula C12H25N3 and a molecular weight of 211.35 g/mol. Its IUPAC name is (Z)-N-ethyl-N',3-dimethyl-N-[2-(methylamino)ethyl]pent-2-enimidamide.

Molecular Properties

Compound Name(Z)-N-ethyl-N',3-dimethyl-N-[2-(methylamino)ethyl]pent-2-enimidamide
PubChem CID142398174
Molecular FormulaC12H25N3
Molecular Weight211.35 g/mol
Exact Mass211.20
IUPAC Name(Z)-N-ethyl-N',3-dimethyl-N-[2-(methylamino)ethyl]pent-2-enimidamide
SMILESCC/C(C)=C\C(=N/C)N(CC)CCNC
InChIInChI=1S/C12H25N3/c1-6-11(3)10-12(14-5)15(7-2)9-8-13-4/h10,13H,6-9H2,1-5H3/b11-10-,14-12+
InChIKeyXGWKUZILNMYQCV-HSINTONASA-N
XLogP1.91
TPSA27.63 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.35
LogP ≤ 51.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-[(E)-pent-1-enyl]-4,5-dihydro-1H-imidazole
CID 21608209
2-[(E)-but-1-enyl]-4,5-dihydro-1H-imidazole
CID 15471712
N'-(2,3-dihydropyridin-6-yl)ethane-1,2-diamine
CID 70309686
2-(4-methylpenta-1,3-dien-2-yl)-4,5-dihydro-1H-imidazole
CID 90077005
N'-methyl-N-(3-methylhex-3-enyl)propanimidamide
CID 91334191
N'-methyl-N-[2-(propylamino)ethyl]pent-2-enimidamide
CID 123457161
N-(2,3-dihydropyridin-6-yl)-N'-propan-2-ylethane-1,2-diamine
CID 129045666
N-[(Z)-3,4-dimethylpent-2-enyl]-N'-methylethanimidamide
CID 130348654
(Z)-N,N',3-trimethylpent-2-enimidamide
CID 142051323
2-(1,4-dihydroazepin-7-ylideneamino)-N-ethyl-N-methylethanamine
CID 143094160
ethanamine;(Z)-N-ethyl-N'-methylpent-2-enimidamide
CID 143576284
(Z)-N-ethyl-N'-methylpent-2-enimidamide
CID 143576285

Frequently Asked Questions

What is the IUPAC name of (Z)-N-ethyl-N',3-dimethyl-N-[2-(methylamino)ethyl]pent-2-enimidamide?
The IUPAC name of (Z)-N-ethyl-N',3-dimethyl-N-[2-(methylamino)ethyl]pent-2-enimidamide (CID 142398174) is (Z)-N-ethyl-N',3-dimethyl-N-[2-(methylamino)ethyl]pent-2-enimidamide.
What is the SMILES notation for (Z)-N-ethyl-N',3-dimethyl-N-[2-(methylamino)ethyl]pent-2-enimidamide?
The canonical SMILES for (Z)-N-ethyl-N',3-dimethyl-N-[2-(methylamino)ethyl]pent-2-enimidamide is CC/C(C)=C\C(=N/C)N(CC)CCNC.
What is the InChIKey of (Z)-N-ethyl-N',3-dimethyl-N-[2-(methylamino)ethyl]pent-2-enimidamide?
The InChIKey is XGWKUZILNMYQCV-HSINTONASA-N. The full InChI is InChI=1S/C12H25N3/c1-6-11(3)10-12(14-5)15(7-2)9-8-13-4/h10,13H,6-9H2,1-5H3/b11-10-,14-12+.
What are the key properties of (Z)-N-ethyl-N',3-dimethyl-N-[2-(methylamino)ethyl]pent-2-enimidamide?
(Z)-N-ethyl-N',3-dimethyl-N-[2-(methylamino)ethyl]pent-2-enimidamide has a molecular weight of 211.35 g/mol, XLogP of 1.91, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-N-ethyl-N',3-dimethyl-N-[2-(methylamino)ethyl]pent-2-enimidamide is sourced from PubChem (CID 142398174), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).