N,N-dimethyl-2-(4-pyrrolidin-2-ylpiperidin-1-yl)propanamide

C14H27N3O — CID 63259226

IUPACN,N-dimethyl-2-(4-pyrrolidin-2-ylpiperidin-1-yl)propanamide
SMILESCC(C(=O)N(C)C)N1CCC(C2CCCN2)CC1
InChIInChI=1S/C14H27N3O/c1-11(14(18)16(2)3)17-9-6-12(7-10-17)13-5-4-8-15-13/h11-13,15H,4-10H2,1-3H3
InChIKeyKLNRXFAENVQKEH-UHFFFAOYSA-N
MW253.39 g/mol
LogP0.93
Rot. Bonds3

About N,N-dimethyl-2-(4-pyrrolidin-2-ylpiperidin-1-yl)propanamide

N,N-dimethyl-2-(4-pyrrolidin-2-ylpiperidin-1-yl)propanamide (PubChem CID 63259226) has the molecular formula C14H27N3O and a molecular weight of 253.39 g/mol. Its IUPAC name is N,N-dimethyl-2-(4-pyrrolidin-2-ylpiperidin-1-yl)propanamide.

Molecular Properties

Compound NameN,N-dimethyl-2-(4-pyrrolidin-2-ylpiperidin-1-yl)propanamide
PubChem CID63259226
Molecular FormulaC14H27N3O
Molecular Weight253.39 g/mol
Exact Mass253.22
IUPAC NameN,N-dimethyl-2-(4-pyrrolidin-2-ylpiperidin-1-yl)propanamide
SMILESCC(C(=O)N(C)C)N1CCC(C2CCCN2)CC1
InChIInChI=1S/C14H27N3O/c1-11(14(18)16(2)3)17-9-6-12(7-10-17)13-5-4-8-15-13/h11-13,15H,4-10H2,1-3H3
InChIKeyKLNRXFAENVQKEH-UHFFFAOYSA-N
XLogP0.93
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.39
LogP ≤ 50.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2-(4-pyrrolidin-2-ylpiperidin-1-yl)propanamide?
The IUPAC name of N,N-dimethyl-2-(4-pyrrolidin-2-ylpiperidin-1-yl)propanamide (CID 63259226) is N,N-dimethyl-2-(4-pyrrolidin-2-ylpiperidin-1-yl)propanamide.
What is the SMILES notation for N,N-dimethyl-2-(4-pyrrolidin-2-ylpiperidin-1-yl)propanamide?
The canonical SMILES for N,N-dimethyl-2-(4-pyrrolidin-2-ylpiperidin-1-yl)propanamide is CC(C(=O)N(C)C)N1CCC(C2CCCN2)CC1.
What is the InChIKey of N,N-dimethyl-2-(4-pyrrolidin-2-ylpiperidin-1-yl)propanamide?
The InChIKey is KLNRXFAENVQKEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N3O/c1-11(14(18)16(2)3)17-9-6-12(7-10-17)13-5-4-8-15-13/h11-13,15H,4-10H2,1-3H3.
What are the key properties of N,N-dimethyl-2-(4-pyrrolidin-2-ylpiperidin-1-yl)propanamide?
N,N-dimethyl-2-(4-pyrrolidin-2-ylpiperidin-1-yl)propanamide has a molecular weight of 253.39 g/mol, XLogP of 0.93, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2-(4-pyrrolidin-2-ylpiperidin-1-yl)propanamide is sourced from PubChem (CID 63259226), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).