N-(2-cyano-3-methylbutan-2-yl)-2-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]acetamide

C14H23N5O — CID 47109711

IUPACN-(2-cyano-3-methylbutan-2-yl)-2-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]acetamide
SMILESCC(C)C(C)(C#N)NC(=O)CN(C)Cc1cnn(C)c1
InChIInChI=1S/C14H23N5O/c1-11(2)14(3,10-15)17-13(20)9-18(4)7-12-6-16-19(5)8-12/h6,8,11H,7,9H2,1-5H3,(H,17,20)
InChIKeyNWCZFNOKPOWXHT-UHFFFAOYSA-N
MW277.37 g/mol
LogP0.91
Rot. Bonds6

About N-(2-cyano-3-methylbutan-2-yl)-2-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]acetamide

N-(2-cyano-3-methylbutan-2-yl)-2-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]acetamide (PubChem CID 47109711) has the molecular formula C14H23N5O and a molecular weight of 277.37 g/mol. Its IUPAC name is N-(2-cyano-3-methylbutan-2-yl)-2-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]acetamide.

Molecular Properties

Compound NameN-(2-cyano-3-methylbutan-2-yl)-2-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]acetamide
PubChem CID47109711
Molecular FormulaC14H23N5O
Molecular Weight277.37 g/mol
Exact Mass277.19
IUPAC NameN-(2-cyano-3-methylbutan-2-yl)-2-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]acetamide
SMILESCC(C)C(C)(C#N)NC(=O)CN(C)Cc1cnn(C)c1
InChIInChI=1S/C14H23N5O/c1-11(2)14(3,10-15)17-13(20)9-18(4)7-12-6-16-19(5)8-12/h6,8,11H,7,9H2,1-5H3,(H,17,20)
InChIKeyNWCZFNOKPOWXHT-UHFFFAOYSA-N
XLogP0.91
TPSA73.95 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 50.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-(2-cyano-3-methylbutan-2-yl)-2-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-cyclopropyl-2-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]acetamide
CID 22196200
2-[(2-bromophenyl)methyl-methylamino]-N-(2-cyano-3-methylbutan-2-yl)acetamide
CID 78790067
2-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]-N-(2,2,2-trifluoroethylcarbamoyl)acetamide
CID 34153757
2-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]-N-(prop-2-enylcarbamoyl)acetamide
CID 39780269
4,4-dimethyl-1-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]pentan-3-ol
CID 62625333
N-(3-methoxypropyl)-2-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]acetamide
CID 51183315
3-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]propanehydrazide
CID 63583505
3,3-dimethyl-4-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]butan-2-ol
CID 66452397
methyl 4-[[2-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]acetyl]amino]butanoate
CID 34153497
N-(2-aminophenyl)-2-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]acetamide
CID 61438617
N-(2,3-dimethylphenyl)-2-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]acetamide
CID 22196125
N'-methyl-N'-[(1-methylpyrazol-4-yl)methyl]-N-propan-2-ylethane-1,2-diamine
CID 61442014

Frequently Asked Questions

What is the IUPAC name of N-(2-cyano-3-methylbutan-2-yl)-2-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]acetamide?
The IUPAC name of N-(2-cyano-3-methylbutan-2-yl)-2-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]acetamide (CID 47109711) is N-(2-cyano-3-methylbutan-2-yl)-2-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]acetamide.
What is the SMILES notation for N-(2-cyano-3-methylbutan-2-yl)-2-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]acetamide?
The canonical SMILES for N-(2-cyano-3-methylbutan-2-yl)-2-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]acetamide is CC(C)C(C)(C#N)NC(=O)CN(C)Cc1cnn(C)c1.
What is the InChIKey of N-(2-cyano-3-methylbutan-2-yl)-2-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]acetamide?
The InChIKey is NWCZFNOKPOWXHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N5O/c1-11(2)14(3,10-15)17-13(20)9-18(4)7-12-6-16-19(5)8-12/h6,8,11H,7,9H2,1-5H3,(H,17,20).
What are the key properties of N-(2-cyano-3-methylbutan-2-yl)-2-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]acetamide?
N-(2-cyano-3-methylbutan-2-yl)-2-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]acetamide has a molecular weight of 277.37 g/mol, XLogP of 0.91, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyano-3-methylbutan-2-yl)-2-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]acetamide is sourced from PubChem (CID 47109711), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).