N-propyl-3-pyrrolidin-2-ylpiperidine-1-carboxamide

C13H25N3O — CID 54886149

IUPACN-propyl-3-pyrrolidin-2-ylpiperidine-1-carboxamide
SMILESCCCNC(=O)N1CCCC(C2CCCN2)C1
InChIInChI=1S/C13H25N3O/c1-2-7-15-13(17)16-9-4-5-11(10-16)12-6-3-8-14-12/h11-12,14H,2-10H2,1H3,(H,15,17)
InChIKeyVSMSUPMROJUXMK-UHFFFAOYSA-N
MW239.36 g/mol
LogP1.57
Rot. Bonds3

About N-propyl-3-pyrrolidin-2-ylpiperidine-1-carboxamide

N-propyl-3-pyrrolidin-2-ylpiperidine-1-carboxamide (PubChem CID 54886149) has the molecular formula C13H25N3O and a molecular weight of 239.36 g/mol. Its IUPAC name is N-propyl-3-pyrrolidin-2-ylpiperidine-1-carboxamide.

Molecular Properties

Compound NameN-propyl-3-pyrrolidin-2-ylpiperidine-1-carboxamide
PubChem CID54886149
Molecular FormulaC13H25N3O
Molecular Weight239.36 g/mol
Exact Mass239.20
IUPAC NameN-propyl-3-pyrrolidin-2-ylpiperidine-1-carboxamide
SMILESCCCNC(=O)N1CCCC(C2CCCN2)C1
InChIInChI=1S/C13H25N3O/c1-2-7-15-13(17)16-9-4-5-11(10-16)12-6-3-8-14-12/h11-12,14H,2-10H2,1H3,(H,15,17)
InChIKeyVSMSUPMROJUXMK-UHFFFAOYSA-N
XLogP1.57
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.36
LogP ≤ 51.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze N-propyl-3-pyrrolidin-2-ylpiperidine-1-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

N-butyl-3-pyrrolidin-2-ylpiperidine-1-carboxamide
CID 54886147
(4aS,7aS)-N-propyl-1,2,3,4,4a,5,7,7a-octahydropyrrolo[3,4-b]pyridine-6-carboxamide
CID 102680650
(3R)-3-(1,3-dioxolan-2-yl)-N-propylpiperidine-1-carboxamide
CID 95270427
3-amino-N-propylpiperidine-1-carboxamide
CID 61295715
(3aR,7aR)-N-butyl-1,2,3,3a,4,5,7,7a-octahydropyrrolo[2,3-c]pyridine-6-carboxamide
CID 178199557
(3R)-3-methyl-N-propylpiperazine-1-carboxamide
CID 104974924
(3,5-dimethylphenyl)-(3-pyrrolidin-2-ylpiperidin-1-yl)methanone
CID 60979101
1-[(4aS,7aS)-1,2,3,4,4a,5,7,7a-octahydropyrrolo[3,4-b]pyridin-6-yl]propan-1-one
CID 102679674
3-[1-(propylcarbamoyl)piperidin-3-yl]propanoic acid
CID 55135166
N-butyl-2-(4-pyrrolidin-2-ylpiperidin-1-yl)acetamide
CID 63259352
(2-hydroxyphenyl)-(3-pyrrolidin-2-ylpiperidin-1-yl)methanone
CID 60978290
3-(1,3-dioxolan-2-yl)-N-pentylpiperidine-1-carboxamide
CID 56505796

Frequently Asked Questions

What is the IUPAC name of N-propyl-3-pyrrolidin-2-ylpiperidine-1-carboxamide?
The IUPAC name of N-propyl-3-pyrrolidin-2-ylpiperidine-1-carboxamide (CID 54886149) is N-propyl-3-pyrrolidin-2-ylpiperidine-1-carboxamide.
What is the SMILES notation for N-propyl-3-pyrrolidin-2-ylpiperidine-1-carboxamide?
The canonical SMILES for N-propyl-3-pyrrolidin-2-ylpiperidine-1-carboxamide is CCCNC(=O)N1CCCC(C2CCCN2)C1.
What is the InChIKey of N-propyl-3-pyrrolidin-2-ylpiperidine-1-carboxamide?
The InChIKey is VSMSUPMROJUXMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N3O/c1-2-7-15-13(17)16-9-4-5-11(10-16)12-6-3-8-14-12/h11-12,14H,2-10H2,1H3,(H,15,17).
What are the key properties of N-propyl-3-pyrrolidin-2-ylpiperidine-1-carboxamide?
N-propyl-3-pyrrolidin-2-ylpiperidine-1-carboxamide has a molecular weight of 239.36 g/mol, XLogP of 1.57, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-propyl-3-pyrrolidin-2-ylpiperidine-1-carboxamide is sourced from PubChem (CID 54886149), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).