2-(aminomethyl)-N-methyl-3-(1-propylpyrazol-4-yl)propanamide

C11H20N4O — CID 103572343

IUPAC2-(aminomethyl)-N-methyl-3-(1-propylpyrazol-4-yl)propanamide
SMILESCCCn1cc(CC(CN)C(=O)NC)cn1
InChIInChI=1S/C11H20N4O/c1-3-4-15-8-9(7-14-15)5-10(6-12)11(16)13-2/h7-8,10H,3-6,12H2,1-2H3,(H,13,16)
InChIKeyWUGHFINICDXUQG-UHFFFAOYSA-N
MW224.31 g/mol
LogP0.16
Rot. Bonds6

About 2-(aminomethyl)-N-methyl-3-(1-propylpyrazol-4-yl)propanamide

2-(aminomethyl)-N-methyl-3-(1-propylpyrazol-4-yl)propanamide (PubChem CID 103572343) has the molecular formula C11H20N4O and a molecular weight of 224.31 g/mol. Its IUPAC name is 2-(aminomethyl)-N-methyl-3-(1-propylpyrazol-4-yl)propanamide.

Molecular Properties

Compound Name2-(aminomethyl)-N-methyl-3-(1-propylpyrazol-4-yl)propanamide
PubChem CID103572343
Molecular FormulaC11H20N4O
Molecular Weight224.31 g/mol
Exact Mass224.16
IUPAC Name2-(aminomethyl)-N-methyl-3-(1-propylpyrazol-4-yl)propanamide
SMILESCCCn1cc(CC(CN)C(=O)NC)cn1
InChIInChI=1S/C11H20N4O/c1-3-4-15-8-9(7-14-15)5-10(6-12)11(16)13-2/h7-8,10H,3-6,12H2,1-2H3,(H,13,16)
InChIKeyWUGHFINICDXUQG-UHFFFAOYSA-N
XLogP0.16
TPSA72.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.31
LogP ≤ 50.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

(2R)-2-(aminomethyl)-3-(1-methylpyrazol-4-yl)propanoic acid
CID 29061487
methyl 4-amino-3-(1-propylpyrazol-4-yl)butanoate
CID 103573475
methyl 2-amino-2-(1-propylpyrazol-4-yl)acetate
CID 103572127
N-methyl-2-[2-[(1-propylpyrazol-4-yl)methylamino]phenyl]acetamide
CID 103818567
2-methyl-2-[(1-propylpyrazol-4-yl)methylamino]propanamide
CID 103571495
2-[(1-propylpyrazol-4-yl)methylamino]ethylurea
CID 103571628
2-(aminomethyl)-N,N-dimethyl-3-(1-methylpyrazol-4-yl)propanamide
CID 62082595
4-[(1-propylpyrazol-4-yl)methylamino]butanamide
CID 103571480
1-(1-pentylpyrazol-4-yl)butan-2-amine
CID 62731678
5-[(1-propylpyrazol-4-yl)methylamino]pentanamide
CID 114161780
3-(methylamino)-3-(1-propylpyrazol-4-yl)propanamide
CID 103573447
(1-propylpyrazol-4-yl)methanethiol
CID 103573669

Frequently Asked Questions

What is the IUPAC name of 2-(aminomethyl)-N-methyl-3-(1-propylpyrazol-4-yl)propanamide?
The IUPAC name of 2-(aminomethyl)-N-methyl-3-(1-propylpyrazol-4-yl)propanamide (CID 103572343) is 2-(aminomethyl)-N-methyl-3-(1-propylpyrazol-4-yl)propanamide.
What is the SMILES notation for 2-(aminomethyl)-N-methyl-3-(1-propylpyrazol-4-yl)propanamide?
The canonical SMILES for 2-(aminomethyl)-N-methyl-3-(1-propylpyrazol-4-yl)propanamide is CCCn1cc(CC(CN)C(=O)NC)cn1.
What is the InChIKey of 2-(aminomethyl)-N-methyl-3-(1-propylpyrazol-4-yl)propanamide?
The InChIKey is WUGHFINICDXUQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N4O/c1-3-4-15-8-9(7-14-15)5-10(6-12)11(16)13-2/h7-8,10H,3-6,12H2,1-2H3,(H,13,16).
What are the key properties of 2-(aminomethyl)-N-methyl-3-(1-propylpyrazol-4-yl)propanamide?
2-(aminomethyl)-N-methyl-3-(1-propylpyrazol-4-yl)propanamide has a molecular weight of 224.31 g/mol, XLogP of 0.16, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(aminomethyl)-N-methyl-3-(1-propylpyrazol-4-yl)propanamide is sourced from PubChem (CID 103572343), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).