(3Z)-1-methyl-3-(3-methyl-5-methylimino-2-oxoimidazolidin-4-ylidene)urea

C7H11N5O2 — CID 135490617

IUPAC(3Z)-1-methyl-3-(3-methyl-5-methylimino-2-oxoimidazolidin-4-ylidene)urea
SMILESC/N=C1\NC(=O)N(C)\C1=N/C(=O)NC
InChIInChI=1S/C7H11N5O2/c1-8-4-5(11-6(13)9-2)12(3)7(14)10-4/h1-3H3,(H,9,13)(H,8,10,14)/b11-5-
InChIKeyJVBZGUMKPRFLFZ-WZUFQYTHSA-N
MW197.20 g/mol
LogP-0.59
Rot. Bonds

About (3Z)-1-methyl-3-(3-methyl-5-methylimino-2-oxoimidazolidin-4-ylidene)urea

(3Z)-1-methyl-3-(3-methyl-5-methylimino-2-oxoimidazolidin-4-ylidene)urea (PubChem CID 135490617) has the molecular formula C7H11N5O2 and a molecular weight of 197.20 g/mol. Its IUPAC name is (3Z)-1-methyl-3-(3-methyl-5-methylimino-2-oxoimidazolidin-4-ylidene)urea.

Molecular Properties

Compound Name(3Z)-1-methyl-3-(3-methyl-5-methylimino-2-oxoimidazolidin-4-ylidene)urea
PubChem CID135490617
Molecular FormulaC7H11N5O2
Molecular Weight197.20 g/mol
Exact Mass197.09
IUPAC Name(3Z)-1-methyl-3-(3-methyl-5-methylimino-2-oxoimidazolidin-4-ylidene)urea
SMILESC/N=C1\NC(=O)N(C)\C1=N/C(=O)NC
InChIInChI=1S/C7H11N5O2/c1-8-4-5(11-6(13)9-2)12(3)7(14)10-4/h1-3H3,(H,9,13)(H,8,10,14)/b11-5-
InChIKeyJVBZGUMKPRFLFZ-WZUFQYTHSA-N
XLogP-0.59
TPSA86.16 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.20
LogP ≤ 5-0.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

(3E)-1-methyl-3-(3-methyl-5-methylimino-2-oxoimidazolidin-4-ylidene)urea
CID 135788704
(1Z)-1-(1,3-dimethyl-2,5-dioxoimidazolidin-4-ylidene)-3-methylurea
CID 133614616
1,3-Dimethyl-4,5-bis(methylimino)imidazolidin-2-one
CID 20695120
3-(methoxymethyl)-1H-imidazo[4,5-d]imidazole-2,5-dione
CID 136332554
4-Ethyliminoimidazolidin-2-one
CID 140604957
(4Z)-N,3-dimethyl-4-(methylcarbamoylimino)-2-oxoimidazolidine-1-carboxamide
CID 10680797

Frequently Asked Questions

What is the IUPAC name of (3Z)-1-methyl-3-(3-methyl-5-methylimino-2-oxoimidazolidin-4-ylidene)urea?
The IUPAC name of (3Z)-1-methyl-3-(3-methyl-5-methylimino-2-oxoimidazolidin-4-ylidene)urea (CID 135490617) is (3Z)-1-methyl-3-(3-methyl-5-methylimino-2-oxoimidazolidin-4-ylidene)urea.
What is the SMILES notation for (3Z)-1-methyl-3-(3-methyl-5-methylimino-2-oxoimidazolidin-4-ylidene)urea?
The canonical SMILES for (3Z)-1-methyl-3-(3-methyl-5-methylimino-2-oxoimidazolidin-4-ylidene)urea is C/N=C1\NC(=O)N(C)\C1=N/C(=O)NC.
What is the InChIKey of (3Z)-1-methyl-3-(3-methyl-5-methylimino-2-oxoimidazolidin-4-ylidene)urea?
The InChIKey is JVBZGUMKPRFLFZ-WZUFQYTHSA-N. The full InChI is InChI=1S/C7H11N5O2/c1-8-4-5(11-6(13)9-2)12(3)7(14)10-4/h1-3H3,(H,9,13)(H,8,10,14)/b11-5-.
What are the key properties of (3Z)-1-methyl-3-(3-methyl-5-methylimino-2-oxoimidazolidin-4-ylidene)urea?
(3Z)-1-methyl-3-(3-methyl-5-methylimino-2-oxoimidazolidin-4-ylidene)urea has a molecular weight of 197.20 g/mol, XLogP of -0.59, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3Z)-1-methyl-3-(3-methyl-5-methylimino-2-oxoimidazolidin-4-ylidene)urea is sourced from PubChem (CID 135490617), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).