2-amino-N-[2-methyl-2-(1H-pyrrol-2-yl)propyl]acetamide

C10H17N3O — CID 115151835

IUPAC2-amino-N-[2-methyl-2-(1H-pyrrol-2-yl)propyl]acetamide
SMILESCC(C)(CNC(=O)CN)c1ccc[nH]1
InChIInChI=1S/C10H17N3O/c1-10(2,7-13-9(14)6-11)8-4-3-5-12-8/h3-5,12H,6-7,11H2,1-2H3,(H,13,14)
InChIKeyMSNBJIXXSGRMPA-UHFFFAOYSA-N
MW195.27 g/mol
LogP0.37
Rot. Bonds4

About 2-amino-N-[2-methyl-2-(1H-pyrrol-2-yl)propyl]acetamide

2-amino-N-[2-methyl-2-(1H-pyrrol-2-yl)propyl]acetamide (PubChem CID 115151835) has the molecular formula C10H17N3O and a molecular weight of 195.27 g/mol. Its IUPAC name is 2-amino-N-[2-methyl-2-(1H-pyrrol-2-yl)propyl]acetamide.

Molecular Properties

Compound Name2-amino-N-[2-methyl-2-(1H-pyrrol-2-yl)propyl]acetamide
PubChem CID115151835
Molecular FormulaC10H17N3O
Molecular Weight195.27 g/mol
Exact Mass195.14
IUPAC Name2-amino-N-[2-methyl-2-(1H-pyrrol-2-yl)propyl]acetamide
SMILESCC(C)(CNC(=O)CN)c1ccc[nH]1
InChIInChI=1S/C10H17N3O/c1-10(2,7-13-9(14)6-11)8-4-3-5-12-8/h3-5,12H,6-7,11H2,1-2H3,(H,13,14)
InChIKeyMSNBJIXXSGRMPA-UHFFFAOYSA-N
XLogP0.37
TPSA70.91 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.27
LogP ≤ 50.37
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Related Compounds

2-hydroxy-N-[2-methyl-2-(1H-pyrrol-2-yl)propyl]acetamide
CID 115140296
4-amino-3-methyl-N-[2-methyl-2-(1H-pyrrol-2-yl)propyl]butanamide
CID 115156513
2-methyl-1-N-[2-methyl-2-(1H-pyrrol-2-yl)propyl]propane-1,2-diamine
CID 115136357
N-[2-methyl-2-(1H-pyrrol-2-yl)propyl]-2-morpholin-2-ylacetamide
CID 115178241
2-amino-N-[2-(2,6-dichlorophenyl)-2-methylpropyl]acetamide
CID 119319554
2-amino-N-[2-(2,6-dichlorophenyl)-2-methylpropyl]acetamide;hydrochloride
CID 119319553
2-amino-N-(2,2-dimethyl-3-phenylpropyl)acetamide
CID 119329644
(2R)-2-amino-2-(1H-pyrrol-2-yl)propanoic acid
CID 130971072
2-amino-N-[2-(2-methoxyphenyl)-2-methylpropyl]acetamide
CID 115151861
2-amino-N-[2-oxo-2-(1H-pyrrol-2-yl)ethyl]acetamide
CID 66569055
2-amino-N-[2-methyl-2-(4-methylsulfanylphenyl)propyl]acetamide
CID 115151844
2-methyl-2-(1H-pyrrol-2-yl)propane-1-thiol
CID 116866465

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[2-methyl-2-(1H-pyrrol-2-yl)propyl]acetamide?
The IUPAC name of 2-amino-N-[2-methyl-2-(1H-pyrrol-2-yl)propyl]acetamide (CID 115151835) is 2-amino-N-[2-methyl-2-(1H-pyrrol-2-yl)propyl]acetamide.
What is the SMILES notation for 2-amino-N-[2-methyl-2-(1H-pyrrol-2-yl)propyl]acetamide?
The canonical SMILES for 2-amino-N-[2-methyl-2-(1H-pyrrol-2-yl)propyl]acetamide is CC(C)(CNC(=O)CN)c1ccc[nH]1.
What is the InChIKey of 2-amino-N-[2-methyl-2-(1H-pyrrol-2-yl)propyl]acetamide?
The InChIKey is MSNBJIXXSGRMPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O/c1-10(2,7-13-9(14)6-11)8-4-3-5-12-8/h3-5,12H,6-7,11H2,1-2H3,(H,13,14).
What are the key properties of 2-amino-N-[2-methyl-2-(1H-pyrrol-2-yl)propyl]acetamide?
2-amino-N-[2-methyl-2-(1H-pyrrol-2-yl)propyl]acetamide has a molecular weight of 195.27 g/mol, XLogP of 0.37, 4 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[2-methyl-2-(1H-pyrrol-2-yl)propyl]acetamide is sourced from PubChem (CID 115151835), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).