N-[(1R)-1-cyclopropylethyl]-6-methylpyridine-2-carboxamide

C12H16N2O — CID 33045236

IUPACN-[(1R)-1-cyclopropylethyl]-6-methylpyridine-2-carboxamide
SMILESCc1cccc(C(=O)N[C@H](C)C2CC2)n1
InChIInChI=1S/C12H16N2O/c1-8-4-3-5-11(13-8)12(15)14-9(2)10-6-7-10/h3-5,9-10H,6-7H2,1-2H3,(H,14,15)/t9-/m1/s1
InChIKeyHZPLHNFJXLSHCY-SECBINFHSA-N
MW204.27 g/mol
LogP1.92
Rot. Bonds3

About N-[(1R)-1-cyclopropylethyl]-6-methylpyridine-2-carboxamide

N-[(1R)-1-cyclopropylethyl]-6-methylpyridine-2-carboxamide (PubChem CID 33045236) has the molecular formula C12H16N2O and a molecular weight of 204.27 g/mol. Its IUPAC name is N-[(1R)-1-cyclopropylethyl]-6-methylpyridine-2-carboxamide.

Molecular Properties

Compound NameN-[(1R)-1-cyclopropylethyl]-6-methylpyridine-2-carboxamide
PubChem CID33045236
Molecular FormulaC12H16N2O
Molecular Weight204.27 g/mol
Exact Mass204.13
IUPAC NameN-[(1R)-1-cyclopropylethyl]-6-methylpyridine-2-carboxamide
SMILESCc1cccc(C(=O)N[C@H](C)C2CC2)n1
InChIInChI=1S/C12H16N2O/c1-8-4-3-5-11(13-8)12(15)14-9(2)10-6-7-10/h3-5,9-10H,6-7H2,1-2H3,(H,14,15)/t9-/m1/s1
InChIKeyHZPLHNFJXLSHCY-SECBINFHSA-N
XLogP1.92
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.27
LogP ≤ 51.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[(1R)-1-cyclopropylethyl]-6-methylpyridine-2-carboxamide?
The IUPAC name of N-[(1R)-1-cyclopropylethyl]-6-methylpyridine-2-carboxamide (CID 33045236) is N-[(1R)-1-cyclopropylethyl]-6-methylpyridine-2-carboxamide.
What is the SMILES notation for N-[(1R)-1-cyclopropylethyl]-6-methylpyridine-2-carboxamide?
The canonical SMILES for N-[(1R)-1-cyclopropylethyl]-6-methylpyridine-2-carboxamide is Cc1cccc(C(=O)N[C@H](C)C2CC2)n1.
What is the InChIKey of N-[(1R)-1-cyclopropylethyl]-6-methylpyridine-2-carboxamide?
The InChIKey is HZPLHNFJXLSHCY-SECBINFHSA-N. The full InChI is InChI=1S/C12H16N2O/c1-8-4-3-5-11(13-8)12(15)14-9(2)10-6-7-10/h3-5,9-10H,6-7H2,1-2H3,(H,14,15)/t9-/m1/s1.
What are the key properties of N-[(1R)-1-cyclopropylethyl]-6-methylpyridine-2-carboxamide?
N-[(1R)-1-cyclopropylethyl]-6-methylpyridine-2-carboxamide has a molecular weight of 204.27 g/mol, XLogP of 1.92, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R)-1-cyclopropylethyl]-6-methylpyridine-2-carboxamide is sourced from PubChem (CID 33045236), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).