2-amino-N,2-dimethyl-N-[(1-methylpyrazol-4-yl)methyl]propanamide

C10H18N4O — CID 61265030

IUPAC2-amino-N,2-dimethyl-N-[(1-methylpyrazol-4-yl)methyl]propanamide
SMILESCN(Cc1cnn(C)c1)C(=O)C(C)(C)N
InChIInChI=1S/C10H18N4O/c1-10(2,11)9(15)13(3)6-8-5-12-14(4)7-8/h5,7H,6,11H2,1-4H3
InChIKeyKTMATAFQDIIRER-UHFFFAOYSA-N
MW210.28 g/mol
LogP0.12
Rot. Bonds3

About 2-amino-N,2-dimethyl-N-[(1-methylpyrazol-4-yl)methyl]propanamide

2-amino-N,2-dimethyl-N-[(1-methylpyrazol-4-yl)methyl]propanamide (PubChem CID 61265030) has the molecular formula C10H18N4O and a molecular weight of 210.28 g/mol. Its IUPAC name is 2-amino-N,2-dimethyl-N-[(1-methylpyrazol-4-yl)methyl]propanamide.

Molecular Properties

Compound Name2-amino-N,2-dimethyl-N-[(1-methylpyrazol-4-yl)methyl]propanamide
PubChem CID61265030
Molecular FormulaC10H18N4O
Molecular Weight210.28 g/mol
Exact Mass210.15
IUPAC Name2-amino-N,2-dimethyl-N-[(1-methylpyrazol-4-yl)methyl]propanamide
SMILESCN(Cc1cnn(C)c1)C(=O)C(C)(C)N
InChIInChI=1S/C10H18N4O/c1-10(2,11)9(15)13(3)6-8-5-12-14(4)7-8/h5,7H,6,11H2,1-4H3
InChIKeyKTMATAFQDIIRER-UHFFFAOYSA-N
XLogP0.12
TPSA64.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.28
LogP ≤ 50.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-amino-N,2,2-trimethyl-N-[(1-methylpyrazol-4-yl)methyl]propanamide;dihydrochloride
CID 119834041
2,2-dimethyl-3-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]-3-oxopropanoic acid
CID 82820708
2-amino-N-ethyl-2-methyl-N-[(1-methylpyrazol-4-yl)methyl]propanamide
CID 119863711
1-methyl-1-[(1-methylpyrazol-4-yl)methyl]urea
CID 60703151
2-carbamothioyl-N,2-dimethyl-N-[(1-methylpyrazol-4-yl)methyl]butanamide
CID 114292030
(2R)-2-amino-N,3,3-trimethyl-N-[(1-methylpyrazol-4-yl)methyl]butanamide
CID 103929109
2-(N'-hydroxycarbamimidoyl)-N,2-dimethyl-N-[(1-methylpyrazol-4-yl)methyl]butanamide
CID 114292736
2-amino-N,3-dimethyl-N-[(1-methylpyrazol-4-yl)methyl]butanamide;dihydrochloride
CID 119834029
2-[methyl-[methyl-[(1-methylpyrazol-4-yl)methyl]carbamoyl]amino]acetic acid
CID 61440246
3,5-diamino-N-methyl-N-[(1-methylpyrazol-4-yl)methyl]benzamide
CID 61139345
2-cyano-N-methyl-N-[(1-methylpyrazol-4-yl)methyl]acetamide
CID 61442217
2,3-dimethyl-4-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]-4-oxobut-2-enoic acid
CID 76992644

Frequently Asked Questions

What is the IUPAC name of 2-amino-N,2-dimethyl-N-[(1-methylpyrazol-4-yl)methyl]propanamide?
The IUPAC name of 2-amino-N,2-dimethyl-N-[(1-methylpyrazol-4-yl)methyl]propanamide (CID 61265030) is 2-amino-N,2-dimethyl-N-[(1-methylpyrazol-4-yl)methyl]propanamide.
What is the SMILES notation for 2-amino-N,2-dimethyl-N-[(1-methylpyrazol-4-yl)methyl]propanamide?
The canonical SMILES for 2-amino-N,2-dimethyl-N-[(1-methylpyrazol-4-yl)methyl]propanamide is CN(Cc1cnn(C)c1)C(=O)C(C)(C)N.
What is the InChIKey of 2-amino-N,2-dimethyl-N-[(1-methylpyrazol-4-yl)methyl]propanamide?
The InChIKey is KTMATAFQDIIRER-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4O/c1-10(2,11)9(15)13(3)6-8-5-12-14(4)7-8/h5,7H,6,11H2,1-4H3.
What are the key properties of 2-amino-N,2-dimethyl-N-[(1-methylpyrazol-4-yl)methyl]propanamide?
2-amino-N,2-dimethyl-N-[(1-methylpyrazol-4-yl)methyl]propanamide has a molecular weight of 210.28 g/mol, XLogP of 0.12, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N,2-dimethyl-N-[(1-methylpyrazol-4-yl)methyl]propanamide is sourced from PubChem (CID 61265030), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).