2-methyl-N-propan-2-yl-N-(pyridin-2-ylmethyl)pyrrolidine-3-carboxamide

C15H23N3O — CID 79388294

IUPAC2-methyl-N-propan-2-yl-N-(pyridin-2-ylmethyl)pyrrolidine-3-carboxamide
SMILESCC1NCCC1C(=O)N(Cc1ccccn1)C(C)C
InChIInChI=1S/C15H23N3O/c1-11(2)18(10-13-6-4-5-8-17-13)15(19)14-7-9-16-12(14)3/h4-6,8,11-12,14,16H,7,9-10H2,1-3H3
InChIKeyLDSXREMIFWJWAF-UHFFFAOYSA-N
MW261.37 g/mol
LogP1.82
Rot. Bonds4

About 2-methyl-N-propan-2-yl-N-(pyridin-2-ylmethyl)pyrrolidine-3-carboxamide

2-methyl-N-propan-2-yl-N-(pyridin-2-ylmethyl)pyrrolidine-3-carboxamide (PubChem CID 79388294) has the molecular formula C15H23N3O and a molecular weight of 261.37 g/mol. Its IUPAC name is 2-methyl-N-propan-2-yl-N-(pyridin-2-ylmethyl)pyrrolidine-3-carboxamide.

Molecular Properties

Compound Name2-methyl-N-propan-2-yl-N-(pyridin-2-ylmethyl)pyrrolidine-3-carboxamide
PubChem CID79388294
Molecular FormulaC15H23N3O
Molecular Weight261.37 g/mol
Exact Mass261.18
IUPAC Name2-methyl-N-propan-2-yl-N-(pyridin-2-ylmethyl)pyrrolidine-3-carboxamide
SMILESCC1NCCC1C(=O)N(Cc1ccccn1)C(C)C
InChIInChI=1S/C15H23N3O/c1-11(2)18(10-13-6-4-5-8-17-13)15(19)14-7-9-16-12(14)3/h4-6,8,11-12,14,16H,7,9-10H2,1-3H3
InChIKeyLDSXREMIFWJWAF-UHFFFAOYSA-N
XLogP1.82
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.37
LogP ≤ 51.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

cis-(1S,2R)-2-[propan-2-yl(pyridin-2-ylmethyl)carbamoyl]cyclopropane-1-carboxylic acid
CID 93378868
(3S)-N-propan-2-yl-N-(pyridin-2-ylmethyl)piperidine-3-carboxamide
CID 81129457
N-benzyl-N-butan-2-yl-2-methylpyrrolidine-3-carboxamide
CID 79389006
3-piperidin-2-yl-N-propan-2-yl-N-(pyridin-2-ylmethyl)propanamide
CID 62210038
1-methyl-2-oxo-N-propan-2-yl-N-(pyridin-2-ylmethyl)piperidine-4-carboxamide
CID 75461730
2-methyl-N-propan-2-yl-N-(2,2,2-trifluoroethyl)pyrrolidine-3-carboxamide
CID 79388128
2-bromo-2-methyl-N-propan-2-yl-N-(pyridin-2-ylmethyl)propanamide
CID 114328230
2-(azetidin-3-ylidene)-N-propan-2-yl-N-(pyridin-2-ylmethyl)propanamide
CID 116676557
3-methyl-N-propan-2-yl-N-(pyridin-2-ylmethyl)but-2-enamide
CID 51088401
cis-(1R,2S)-N-cyclopropyl-2-methyl-N-(pyridin-2-ylmethyl)cyclopropane-1-carboxamide
CID 94822499
1-amino-N-propan-2-yl-N-(pyridin-2-ylmethyl)cyclopentane-1-carboxamide
CID 54872425
cis-(1S,2R)-2-methyl-N-[3-oxo-3-[propan-2-yl(pyridin-2-ylmethyl)amino]propyl]cyclopropane-1-carboxamide
CID 94625593

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-propan-2-yl-N-(pyridin-2-ylmethyl)pyrrolidine-3-carboxamide?
The IUPAC name of 2-methyl-N-propan-2-yl-N-(pyridin-2-ylmethyl)pyrrolidine-3-carboxamide (CID 79388294) is 2-methyl-N-propan-2-yl-N-(pyridin-2-ylmethyl)pyrrolidine-3-carboxamide.
What is the SMILES notation for 2-methyl-N-propan-2-yl-N-(pyridin-2-ylmethyl)pyrrolidine-3-carboxamide?
The canonical SMILES for 2-methyl-N-propan-2-yl-N-(pyridin-2-ylmethyl)pyrrolidine-3-carboxamide is CC1NCCC1C(=O)N(Cc1ccccn1)C(C)C.
What is the InChIKey of 2-methyl-N-propan-2-yl-N-(pyridin-2-ylmethyl)pyrrolidine-3-carboxamide?
The InChIKey is LDSXREMIFWJWAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O/c1-11(2)18(10-13-6-4-5-8-17-13)15(19)14-7-9-16-12(14)3/h4-6,8,11-12,14,16H,7,9-10H2,1-3H3.
What are the key properties of 2-methyl-N-propan-2-yl-N-(pyridin-2-ylmethyl)pyrrolidine-3-carboxamide?
2-methyl-N-propan-2-yl-N-(pyridin-2-ylmethyl)pyrrolidine-3-carboxamide has a molecular weight of 261.37 g/mol, XLogP of 1.82, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-propan-2-yl-N-(pyridin-2-ylmethyl)pyrrolidine-3-carboxamide is sourced from PubChem (CID 79388294), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).