N-cyclopropyl-N-[[(2R)-1-[(3-methyl-2-pyridinyl)methyl]pyrrolidin-2-yl]methyl]acetamide

C17H25N3O — CID 129474004

IUPACN-cyclopropyl-N-[[(2R)-1-[(3-methyl-2-pyridinyl)methyl]pyrrolidin-2-yl]methyl]acetamide
SMILESCC(=O)N(C[C@H]1CCCN1Cc1ncccc1C)C1CC1
InChIInChI=1S/C17H25N3O/c1-13-5-3-9-18-17(13)12-19-10-4-6-16(19)11-20(14(2)21)15-7-8-15/h3,5,9,15-16H,4,6-8,10-12H2,1-2H3/t16-/m1/s1
InChIKeyCTTCGAGOKBQOAQ-MRXNPFEDSA-N
MW287.41 g/mol
LogP2.37
Rot. Bonds5

About N-cyclopropyl-N-[[(2R)-1-[(3-methyl-2-pyridinyl)methyl]pyrrolidin-2-yl]methyl]acetamide

N-cyclopropyl-N-[[(2R)-1-[(3-methyl-2-pyridinyl)methyl]pyrrolidin-2-yl]methyl]acetamide (PubChem CID 129474004) has the molecular formula C17H25N3O and a molecular weight of 287.41 g/mol. Its IUPAC name is N-cyclopropyl-N-[[(2R)-1-[(3-methyl-2-pyridinyl)methyl]pyrrolidin-2-yl]methyl]acetamide.

Molecular Properties

Compound NameN-cyclopropyl-N-[[(2R)-1-[(3-methyl-2-pyridinyl)methyl]pyrrolidin-2-yl]methyl]acetamide
PubChem CID129474004
Molecular FormulaC17H25N3O
Molecular Weight287.41 g/mol
Exact Mass287.20
IUPAC NameN-cyclopropyl-N-[[(2R)-1-[(3-methyl-2-pyridinyl)methyl]pyrrolidin-2-yl]methyl]acetamide
SMILESCC(=O)N(C[C@H]1CCCN1Cc1ncccc1C)C1CC1
InChIInChI=1S/C17H25N3O/c1-13-5-3-9-18-17(13)12-19-10-4-6-16(19)11-20(14(2)21)15-7-8-15/h3,5,9,15-16H,4,6-8,10-12H2,1-2H3/t16-/m1/s1
InChIKeyCTTCGAGOKBQOAQ-MRXNPFEDSA-N
XLogP2.37
TPSA36.44 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.41
LogP ≤ 52.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

[(2R)-1-[(3-methyl-2-pyridinyl)methyl]pyrrolidin-2-yl]methanol
CID 103897843
N-cyclopropyl-N-[[(2R)-1-[(3-hydroxy-6-methyl-2-pyridinyl)methyl]pyrrolidin-2-yl]methyl]acetamide
CID 129474418
3-methyl-1-[(3-methyl-2-pyridinyl)methyl]piperidine-2-carboxylic acid
CID 107072167
2-[[2-(3-chloropropyl)pyrrolidin-1-yl]methyl]-3-methylpyridine
CID 112651342
N-cyclopropyl-N-[[(2R)-1-(imidazo[1,2-a]pyrimidin-3-ylmethyl)pyrrolidin-2-yl]methyl]acetamide
CID 129336564
N-cyclopropyl-N-[[1-[(2-cyclopropyl-1,3-thiazol-5-yl)methyl]pyrrolidin-2-yl]methyl]acetamide
CID 129003015
N-cyclopropyl-N-[[(2R)-1-[(3-ethyl-1-methylpyrazol-4-yl)methyl]pyrrolidin-2-yl]methyl]acetamide
CID 129333358
N-[[1-[(3-methyl-2-pyridinyl)methyl]pyrrolidin-2-yl]methyl]imidazo[1,5-a]pyridine-3-carboxamide
CID 166348925
ethyl 1-[(3-methyl-2-pyridinyl)methyl]piperidine-2-carboxylate
CID 112550209
N'-hydroxy-1-[(3-methyl-2-pyridinyl)methyl]piperidine-2-carboximidamide
CID 112650471
N-cyclopropyl-N-[[1-[2-hydroxy-2-(4-methylphenyl)ethyl]pyrrolidin-2-yl]methyl]acetamide
CID 128967180
N-cyclopropyl-N-[[(2S)-1-[[2-(2-methylpropyl)-1,2,4-triazol-3-yl]methyl]pyrrolidin-2-yl]methyl]acetamide
CID 129330987

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-N-[[(2R)-1-[(3-methyl-2-pyridinyl)methyl]pyrrolidin-2-yl]methyl]acetamide?
The IUPAC name of N-cyclopropyl-N-[[(2R)-1-[(3-methyl-2-pyridinyl)methyl]pyrrolidin-2-yl]methyl]acetamide (CID 129474004) is N-cyclopropyl-N-[[(2R)-1-[(3-methyl-2-pyridinyl)methyl]pyrrolidin-2-yl]methyl]acetamide.
What is the SMILES notation for N-cyclopropyl-N-[[(2R)-1-[(3-methyl-2-pyridinyl)methyl]pyrrolidin-2-yl]methyl]acetamide?
The canonical SMILES for N-cyclopropyl-N-[[(2R)-1-[(3-methyl-2-pyridinyl)methyl]pyrrolidin-2-yl]methyl]acetamide is CC(=O)N(C[C@H]1CCCN1Cc1ncccc1C)C1CC1.
What is the InChIKey of N-cyclopropyl-N-[[(2R)-1-[(3-methyl-2-pyridinyl)methyl]pyrrolidin-2-yl]methyl]acetamide?
The InChIKey is CTTCGAGOKBQOAQ-MRXNPFEDSA-N. The full InChI is InChI=1S/C17H25N3O/c1-13-5-3-9-18-17(13)12-19-10-4-6-16(19)11-20(14(2)21)15-7-8-15/h3,5,9,15-16H,4,6-8,10-12H2,1-2H3/t16-/m1/s1.
What are the key properties of N-cyclopropyl-N-[[(2R)-1-[(3-methyl-2-pyridinyl)methyl]pyrrolidin-2-yl]methyl]acetamide?
N-cyclopropyl-N-[[(2R)-1-[(3-methyl-2-pyridinyl)methyl]pyrrolidin-2-yl]methyl]acetamide has a molecular weight of 287.41 g/mol, XLogP of 2.37, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-N-[[(2R)-1-[(3-methyl-2-pyridinyl)methyl]pyrrolidin-2-yl]methyl]acetamide is sourced from PubChem (CID 129474004), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).