(Z)-4-methyl-1-methyliminopent-2-en-3-amine

C7H14N2 — CID 126729542

IUPAC(Z)-4-methyl-1-methyliminopent-2-en-3-amine
SMILESC/N=C/C=C(\N)C(C)C
InChIInChI=1S/C7H14N2/c1-6(2)7(8)4-5-9-3/h4-6H,8H2,1-3H3/b7-4-,9-5+
InChIKeyPHQNXGBOTCLWBD-ICDOWURLSA-N
MW126.20 g/mol
LogP1.19
Rot. Bonds2

About (Z)-4-methyl-1-methyliminopent-2-en-3-amine

(Z)-4-methyl-1-methyliminopent-2-en-3-amine (PubChem CID 126729542) has the molecular formula C7H14N2 and a molecular weight of 126.20 g/mol. Its IUPAC name is (Z)-4-methyl-1-methyliminopent-2-en-3-amine.

Molecular Properties

Compound Name(Z)-4-methyl-1-methyliminopent-2-en-3-amine
PubChem CID126729542
Molecular FormulaC7H14N2
Molecular Weight126.20 g/mol
Exact Mass126.12
IUPAC Name(Z)-4-methyl-1-methyliminopent-2-en-3-amine
SMILESC/N=C/C=C(\N)C(C)C
InChIInChI=1S/C7H14N2/c1-6(2)7(8)4-5-9-3/h4-6H,8H2,1-3H3/b7-4-,9-5+
InChIKeyPHQNXGBOTCLWBD-ICDOWURLSA-N
XLogP1.19
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500126.20
LogP ≤ 51.19
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

Dihydropyridin-4(1h)-imine
CID 19906283
(Z,1E)-1-(difluoromethylimino)-4-methylpent-2-en-3-amine
CID 138552377
4-Fluoro-1-methyliminopent-2-en-3-amine
CID 173565633
1-(Difluoromethylimino)-4-methylpent-2-en-3-amine
CID 173798777
1-(2-Fluoropropylimino)-4-methylpent-2-en-3-amine
CID 173933086
1-(2-Fluoro-3-methylbut-3-enyl)imino-4-methylpent-2-en-3-amine
CID 173933091
(4S)-4-fluoro-4-methylazepin-3-amine
CID 175192123
(Z)-1-tert-butyliminopent-2-en-3-amine
CID 10986475
2,3-Dihydropyridin-5-amine
CID 54086038
3H-pyridin-1-ium-5-amine
CID 57035951
(Z)-4-methyliminobut-2-en-2-amine
CID 57781891
M-methylpyridin-3,4-diamine
CID 66724566

Frequently Asked Questions

What is the IUPAC name of (Z)-4-methyl-1-methyliminopent-2-en-3-amine?
The IUPAC name of (Z)-4-methyl-1-methyliminopent-2-en-3-amine (CID 126729542) is (Z)-4-methyl-1-methyliminopent-2-en-3-amine.
What is the SMILES notation for (Z)-4-methyl-1-methyliminopent-2-en-3-amine?
The canonical SMILES for (Z)-4-methyl-1-methyliminopent-2-en-3-amine is C/N=C/C=C(\N)C(C)C.
What is the InChIKey of (Z)-4-methyl-1-methyliminopent-2-en-3-amine?
The InChIKey is PHQNXGBOTCLWBD-ICDOWURLSA-N. The full InChI is InChI=1S/C7H14N2/c1-6(2)7(8)4-5-9-3/h4-6H,8H2,1-3H3/b7-4-,9-5+.
What are the key properties of (Z)-4-methyl-1-methyliminopent-2-en-3-amine?
(Z)-4-methyl-1-methyliminopent-2-en-3-amine has a molecular weight of 126.20 g/mol, XLogP of 1.19, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-4-methyl-1-methyliminopent-2-en-3-amine is sourced from PubChem (CID 126729542), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).