N-(1-cyclopropylpiperidin-4-yl)-4-methylpyrrolidine-3-carboxamide

C14H25N3O — CID 55228814

IUPACN-(1-cyclopropylpiperidin-4-yl)-4-methylpyrrolidine-3-carboxamide
SMILESCC1CNCC1C(=O)NC1CCN(C2CC2)CC1
InChIInChI=1S/C14H25N3O/c1-10-8-15-9-13(10)14(18)16-11-4-6-17(7-5-11)12-2-3-12/h10-13,15H,2-9H2,1H3,(H,16,18)
InChIKeyMLBLAKPLOPHTRE-UHFFFAOYSA-N
MW251.37 g/mol
LogP0.58
Rot. Bonds3

About N-(1-cyclopropylpiperidin-4-yl)-4-methylpyrrolidine-3-carboxamide

N-(1-cyclopropylpiperidin-4-yl)-4-methylpyrrolidine-3-carboxamide (PubChem CID 55228814) has the molecular formula C14H25N3O and a molecular weight of 251.37 g/mol. Its IUPAC name is N-(1-cyclopropylpiperidin-4-yl)-4-methylpyrrolidine-3-carboxamide.

Molecular Properties

Compound NameN-(1-cyclopropylpiperidin-4-yl)-4-methylpyrrolidine-3-carboxamide
PubChem CID55228814
Molecular FormulaC14H25N3O
Molecular Weight251.37 g/mol
Exact Mass251.20
IUPAC NameN-(1-cyclopropylpiperidin-4-yl)-4-methylpyrrolidine-3-carboxamide
SMILESCC1CNCC1C(=O)NC1CCN(C2CC2)CC1
InChIInChI=1S/C14H25N3O/c1-10-8-15-9-13(10)14(18)16-11-4-6-17(7-5-11)12-2-3-12/h10-13,15H,2-9H2,1H3,(H,16,18)
InChIKeyMLBLAKPLOPHTRE-UHFFFAOYSA-N
XLogP0.58
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.37
LogP ≤ 50.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1-ethylpiperidin-4-yl)-4-methylpyrrolidine-3-carboxamide
CID 63715986
(3S,4S)-N-(4,4-dimethylcyclohexyl)-4-methylpyrrolidine-3-carboxamide
CID 114084930
4-[(4-methylpyrrolidine-3-carbonyl)amino]cyclohexane-1-carboxylic acid
CID 63715319
(3S,4S)-4-methyl-N-(1-methylazetidin-3-yl)pyrrolidine-3-carboxamide
CID 131204171
4-methyl-N-(1-pyrimidin-2-ylpiperidin-4-yl)pyrrolidine-3-carboxamide
CID 63713938
N-cyclopent-3-en-1-yl-4-methylpyrrolidine-3-carboxamide
CID 115976512
4-methyl-N-(4-propylcyclohexyl)pyrrolidine-3-carboxamide
CID 63714005
(3S,4S)-N-cyclopent-3-en-1-yl-4-methylpyrrolidine-3-carboxamide;hydrochloride
CID 131110722
N-(1-cyclopropylpiperidin-4-yl)-2-methylpiperidine-4-carboxamide
CID 106739107
N-(1-cyclopropylpiperidin-4-yl)cyclopentanecarboxamide
CID 110750777
N-(1-cyclopropylpiperidin-4-yl)-4-methylpiperidine-2-carboxamide
CID 114423145
2-methyl-N-[1-(4-methylpyrrolidine-3-carbonyl)piperidin-4-yl]propanamide
CID 63715305

Frequently Asked Questions

What is the IUPAC name of N-(1-cyclopropylpiperidin-4-yl)-4-methylpyrrolidine-3-carboxamide?
The IUPAC name of N-(1-cyclopropylpiperidin-4-yl)-4-methylpyrrolidine-3-carboxamide (CID 55228814) is N-(1-cyclopropylpiperidin-4-yl)-4-methylpyrrolidine-3-carboxamide.
What is the SMILES notation for N-(1-cyclopropylpiperidin-4-yl)-4-methylpyrrolidine-3-carboxamide?
The canonical SMILES for N-(1-cyclopropylpiperidin-4-yl)-4-methylpyrrolidine-3-carboxamide is CC1CNCC1C(=O)NC1CCN(C2CC2)CC1.
What is the InChIKey of N-(1-cyclopropylpiperidin-4-yl)-4-methylpyrrolidine-3-carboxamide?
The InChIKey is MLBLAKPLOPHTRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3O/c1-10-8-15-9-13(10)14(18)16-11-4-6-17(7-5-11)12-2-3-12/h10-13,15H,2-9H2,1H3,(H,16,18).
What are the key properties of N-(1-cyclopropylpiperidin-4-yl)-4-methylpyrrolidine-3-carboxamide?
N-(1-cyclopropylpiperidin-4-yl)-4-methylpyrrolidine-3-carboxamide has a molecular weight of 251.37 g/mol, XLogP of 0.58, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclopropylpiperidin-4-yl)-4-methylpyrrolidine-3-carboxamide is sourced from PubChem (CID 55228814), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).