N-[(1-methylpiperidin-2-yl)methyl]-2-propylpyrrolidine-2-carboxamide

C15H29N3O — CID 106975036

IUPACN-[(1-methylpiperidin-2-yl)methyl]-2-propylpyrrolidine-2-carboxamide
SMILESCCCC1(C(=O)NCC2CCCCN2C)CCCN1
InChIInChI=1S/C15H29N3O/c1-3-8-15(9-6-10-17-15)14(19)16-12-13-7-4-5-11-18(13)2/h13,17H,3-12H2,1-2H3,(H,16,19)
InChIKeyQRVKRYUVAXFDRY-UHFFFAOYSA-N
MW267.42 g/mol
LogP1.51
Rot. Bonds5

About N-[(1-methylpiperidin-2-yl)methyl]-2-propylpyrrolidine-2-carboxamide

N-[(1-methylpiperidin-2-yl)methyl]-2-propylpyrrolidine-2-carboxamide (PubChem CID 106975036) has the molecular formula C15H29N3O and a molecular weight of 267.42 g/mol. Its IUPAC name is N-[(1-methylpiperidin-2-yl)methyl]-2-propylpyrrolidine-2-carboxamide.

Molecular Properties

Compound NameN-[(1-methylpiperidin-2-yl)methyl]-2-propylpyrrolidine-2-carboxamide
PubChem CID106975036
Molecular FormulaC15H29N3O
Molecular Weight267.42 g/mol
Exact Mass267.23
IUPAC NameN-[(1-methylpiperidin-2-yl)methyl]-2-propylpyrrolidine-2-carboxamide
SMILESCCCC1(C(=O)NCC2CCCCN2C)CCCN1
InChIInChI=1S/C15H29N3O/c1-3-8-15(9-6-10-17-15)14(19)16-12-13-7-4-5-11-18(13)2/h13,17H,3-12H2,1-2H3,(H,16,19)
InChIKeyQRVKRYUVAXFDRY-UHFFFAOYSA-N
XLogP1.51
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.42
LogP ≤ 51.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-[(1-methylpiperidin-2-yl)methyl]-2-propylpyrrolidine-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Gancidin W
CID 7074739
3-Isobutylhexahydropyrrolo[1,2-a]pyrazine-1,4-dione
CID 102892
Posatirelin
CID 71230
cyclo(L-Pro-L-Val)
CID 6992261
Pyrrolo(1,2-a)pyrazine-1,4-dione, hexahydro-3-(1-methylethyl)-
CID 98951
(3R,8aS)-Hexahydro-3-(2-methylpropyl)pyrrolo(1,2-a)pyrazine-1,4-dione
CID 927565
3-sec-Butyl-pyrrolopiperazine-1,4-dione
CID 6428988
(2S)-1-[(2S)-2-[(2S)-2-aminopropanamido]-3-methylbutanoyl]-N-(cyclohexylmethyl)pyrrolidine-2-carboxamide
CID 11176463
Cyclo(Ile-Pro)
CID 13654640
N-[(3S)-2,6-dioxopiperidin-3-yl]-2-propylpentanamide
CID 11107895
(2R)-N-cyclohexyl-1-(2-methylpropyl)pyrrolidine-2-carboxamide
CID 60053628
(3S,8AR)-3-Isobutylhexahydropyrrolo[1,2-a]pyrazine-1,4-dione
CID 7074740

Frequently Asked Questions

What is the IUPAC name of N-[(1-methylpiperidin-2-yl)methyl]-2-propylpyrrolidine-2-carboxamide?
The IUPAC name of N-[(1-methylpiperidin-2-yl)methyl]-2-propylpyrrolidine-2-carboxamide (CID 106975036) is N-[(1-methylpiperidin-2-yl)methyl]-2-propylpyrrolidine-2-carboxamide.
What is the SMILES notation for N-[(1-methylpiperidin-2-yl)methyl]-2-propylpyrrolidine-2-carboxamide?
The canonical SMILES for N-[(1-methylpiperidin-2-yl)methyl]-2-propylpyrrolidine-2-carboxamide is CCCC1(C(=O)NCC2CCCCN2C)CCCN1.
What is the InChIKey of N-[(1-methylpiperidin-2-yl)methyl]-2-propylpyrrolidine-2-carboxamide?
The InChIKey is QRVKRYUVAXFDRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29N3O/c1-3-8-15(9-6-10-17-15)14(19)16-12-13-7-4-5-11-18(13)2/h13,17H,3-12H2,1-2H3,(H,16,19).
What are the key properties of N-[(1-methylpiperidin-2-yl)methyl]-2-propylpyrrolidine-2-carboxamide?
N-[(1-methylpiperidin-2-yl)methyl]-2-propylpyrrolidine-2-carboxamide has a molecular weight of 267.42 g/mol, XLogP of 1.51, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-methylpiperidin-2-yl)methyl]-2-propylpyrrolidine-2-carboxamide is sourced from PubChem (CID 106975036), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).