N-methyl-N-[(4-methyl-1,2,4-triazol-3-yl)methyl]bicyclo[1.1.0]butane-1-carboxamide

C10H14N4O — CID 166425331

IUPACN-methyl-N-[(4-methyl-1,2,4-triazol-3-yl)methyl]bicyclo[1.1.0]butane-1-carboxamide
SMILESCN(Cc1nncn1C)C(=O)C12CC1C2
InChIInChI=1S/C10H14N4O/c1-13(5-8-12-11-6-14(8)2)9(15)10-3-7(10)4-10/h6-7H,3-5H2,1-2H3
InChIKeyDWTMAXHKTFIWFE-UHFFFAOYSA-N
MW206.25 g/mol
LogP0.18
Rot. Bonds3

About N-methyl-N-[(4-methyl-1,2,4-triazol-3-yl)methyl]bicyclo[1.1.0]butane-1-carboxamide

N-methyl-N-[(4-methyl-1,2,4-triazol-3-yl)methyl]bicyclo[1.1.0]butane-1-carboxamide (PubChem CID 166425331) has the molecular formula C10H14N4O and a molecular weight of 206.25 g/mol. Its IUPAC name is N-methyl-N-[(4-methyl-1,2,4-triazol-3-yl)methyl]bicyclo[1.1.0]butane-1-carboxamide.

Molecular Properties

Compound NameN-methyl-N-[(4-methyl-1,2,4-triazol-3-yl)methyl]bicyclo[1.1.0]butane-1-carboxamide
PubChem CID166425331
Molecular FormulaC10H14N4O
Molecular Weight206.25 g/mol
Exact Mass206.12
IUPAC NameN-methyl-N-[(4-methyl-1,2,4-triazol-3-yl)methyl]bicyclo[1.1.0]butane-1-carboxamide
SMILESCN(Cc1nncn1C)C(=O)C12CC1C2
InChIInChI=1S/C10H14N4O/c1-13(5-8-12-11-6-14(8)2)9(15)10-3-7(10)4-10/h6-7H,3-5H2,1-2H3
InChIKeyDWTMAXHKTFIWFE-UHFFFAOYSA-N
XLogP0.18
TPSA51.02 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.25
LogP ≤ 50.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze N-methyl-N-[(4-methyl-1,2,4-triazol-3-yl)methyl]bicyclo[1.1.0]butane-1-carboxamide with MolForge

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Related Compounds

2-methyl-1-[methyl-[(4-methyl-1,2,4-triazol-3-yl)methyl]amino]propan-2-ol
CID 78964774
4-[methyl-[(4-methyl-1,2,4-triazol-3-yl)methyl]amino]butan-2-ol
CID 115666950
formic acid;N-methyl-4-(4-methylpiperazin-1-yl)-N-[(4-methyl-1,2,4-triazol-3-yl)methyl]pentanamide
CID 154909106
methyl 2-[ethyl-[(4-methyl-1,2,4-triazol-3-yl)methyl]amino]acetate
CID 78990543
(3R,4S)-4-fluoro-N-methyl-N-[(4-methyl-1,2,4-triazol-3-yl)methyl]oxolan-3-amine
CID 126856229
N-[(4-methyl-1,2,4-triazol-3-yl)methyl]-3-oxobutanamide
CID 61004110
1-methyl-3-[(2R)-2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]-1-[(4-methyl-1,2,4-triazol-3-yl)methyl]urea
CID 126454901
N-methyl-N-[(4-methyl-1,2,4-triazol-3-yl)methyl]-1-piperidin-2-ylmethanamine
CID 106635758
1-(6-cyclopropylpyridazin-3-yl)-N-methyl-N-[(4-methyl-1,2,4-triazol-3-yl)methyl]azetidin-3-amine
CID 126917379
2-amino-N-[(4-methyl-1,2,4-triazol-3-yl)methyl]cyclopropane-1-carboxamide
CID 82237375
N-methyl-N-[methyl-[(4-methyl-1,2,4-triazol-3-yl)methyl]sulfamoyl]-1-phenylmethanamine
CID 131891219
3,3-dimethyl-N-[(4-methyl-1,2,4-triazol-3-yl)methyl]cyclopentan-1-amine
CID 80706414

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[(4-methyl-1,2,4-triazol-3-yl)methyl]bicyclo[1.1.0]butane-1-carboxamide?
The IUPAC name of N-methyl-N-[(4-methyl-1,2,4-triazol-3-yl)methyl]bicyclo[1.1.0]butane-1-carboxamide (CID 166425331) is N-methyl-N-[(4-methyl-1,2,4-triazol-3-yl)methyl]bicyclo[1.1.0]butane-1-carboxamide.
What is the SMILES notation for N-methyl-N-[(4-methyl-1,2,4-triazol-3-yl)methyl]bicyclo[1.1.0]butane-1-carboxamide?
The canonical SMILES for N-methyl-N-[(4-methyl-1,2,4-triazol-3-yl)methyl]bicyclo[1.1.0]butane-1-carboxamide is CN(Cc1nncn1C)C(=O)C12CC1C2.
What is the InChIKey of N-methyl-N-[(4-methyl-1,2,4-triazol-3-yl)methyl]bicyclo[1.1.0]butane-1-carboxamide?
The InChIKey is DWTMAXHKTFIWFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N4O/c1-13(5-8-12-11-6-14(8)2)9(15)10-3-7(10)4-10/h6-7H,3-5H2,1-2H3.
What are the key properties of N-methyl-N-[(4-methyl-1,2,4-triazol-3-yl)methyl]bicyclo[1.1.0]butane-1-carboxamide?
N-methyl-N-[(4-methyl-1,2,4-triazol-3-yl)methyl]bicyclo[1.1.0]butane-1-carboxamide has a molecular weight of 206.25 g/mol, XLogP of 0.18, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[(4-methyl-1,2,4-triazol-3-yl)methyl]bicyclo[1.1.0]butane-1-carboxamide is sourced from PubChem (CID 166425331), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).