N-(6-amino-3-pyridinyl)-N-methyl-2-(1H-pyrrol-2-yl)acetamide

C12H14N4O — CID 115274591

IUPACN-(6-amino-3-pyridinyl)-N-methyl-2-(1H-pyrrol-2-yl)acetamide
SMILESCN(C(=O)Cc1ccc[nH]1)c1ccc(N)nc1
InChIInChI=1S/C12H14N4O/c1-16(10-4-5-11(13)15-8-10)12(17)7-9-3-2-6-14-9/h2-6,8,14H,7H2,1H3,(H2,13,15)
InChIKeyRXMLGKZALHNSMH-UHFFFAOYSA-N
MW230.27 g/mol
LogP1.20
Rot. Bonds3

About N-(6-amino-3-pyridinyl)-N-methyl-2-(1H-pyrrol-2-yl)acetamide

N-(6-amino-3-pyridinyl)-N-methyl-2-(1H-pyrrol-2-yl)acetamide (PubChem CID 115274591) has the molecular formula C12H14N4O and a molecular weight of 230.27 g/mol. Its IUPAC name is N-(6-amino-3-pyridinyl)-N-methyl-2-(1H-pyrrol-2-yl)acetamide.

Molecular Properties

Compound NameN-(6-amino-3-pyridinyl)-N-methyl-2-(1H-pyrrol-2-yl)acetamide
PubChem CID115274591
Molecular FormulaC12H14N4O
Molecular Weight230.27 g/mol
Exact Mass230.12
IUPAC NameN-(6-amino-3-pyridinyl)-N-methyl-2-(1H-pyrrol-2-yl)acetamide
SMILESCN(C(=O)Cc1ccc[nH]1)c1ccc(N)nc1
InChIInChI=1S/C12H14N4O/c1-16(10-4-5-11(13)15-8-10)12(17)7-9-3-2-6-14-9/h2-6,8,14H,7H2,1H3,(H2,13,15)
InChIKeyRXMLGKZALHNSMH-UHFFFAOYSA-N
XLogP1.20
TPSA75.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.27
LogP ≤ 51.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(6-amino-3-pyridinyl)-N-methyl-1H-pyrrole-2-carboxamide
CID 115274565
N-(6-amino-3-pyridinyl)-N-methylbutanamide
CID 115268400
N-(6-amino-3-pyridinyl)-N-methyl-3-(2-methylphenyl)propanamide
CID 115274616
N-(6-amino-3-pyridinyl)-N-methyl-4-(1H-pyrrol-3-yl)butanamide
CID 115274634
methyl N-(6-amino-3-pyridinyl)-N-methylcarbamate
CID 115268442
N-(6-amino-3-pyridinyl)-4-fluoro-N-methylbenzamide
CID 115268417
N-(6-amino-3-pyridinyl)-N-methyl-1H-indole-3-carboxamide
CID 115274564
2-[(6-amino-3-pyridinyl)-methylamino]acetamide
CID 43374025
N-benzyl-N-methyl-2-(1H-pyrrol-2-yl)acetamide
CID 110690806
5-N-(6-amino-3-pyridinyl)-5-N-methyl-1H-imidazole-4,5-dicarboxamide
CID 118419223
N-(6-amino-3-pyridinyl)-N,3,4-trimethylbenzamide
CID 115268424
2-amino-N-methyl-N-(6-methyl-3-pyridinyl)acetamide
CID 134406408

Frequently Asked Questions

What is the IUPAC name of N-(6-amino-3-pyridinyl)-N-methyl-2-(1H-pyrrol-2-yl)acetamide?
The IUPAC name of N-(6-amino-3-pyridinyl)-N-methyl-2-(1H-pyrrol-2-yl)acetamide (CID 115274591) is N-(6-amino-3-pyridinyl)-N-methyl-2-(1H-pyrrol-2-yl)acetamide.
What is the SMILES notation for N-(6-amino-3-pyridinyl)-N-methyl-2-(1H-pyrrol-2-yl)acetamide?
The canonical SMILES for N-(6-amino-3-pyridinyl)-N-methyl-2-(1H-pyrrol-2-yl)acetamide is CN(C(=O)Cc1ccc[nH]1)c1ccc(N)nc1.
What is the InChIKey of N-(6-amino-3-pyridinyl)-N-methyl-2-(1H-pyrrol-2-yl)acetamide?
The InChIKey is RXMLGKZALHNSMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N4O/c1-16(10-4-5-11(13)15-8-10)12(17)7-9-3-2-6-14-9/h2-6,8,14H,7H2,1H3,(H2,13,15).
What are the key properties of N-(6-amino-3-pyridinyl)-N-methyl-2-(1H-pyrrol-2-yl)acetamide?
N-(6-amino-3-pyridinyl)-N-methyl-2-(1H-pyrrol-2-yl)acetamide has a molecular weight of 230.27 g/mol, XLogP of 1.20, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-amino-3-pyridinyl)-N-methyl-2-(1H-pyrrol-2-yl)acetamide is sourced from PubChem (CID 115274591), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).