N-methyl-N-[(1-methylpyrrolidin-2-yl)methyl]-3-piperidin-2-ylpropanamide

C15H29N3O — CID 79314839

IUPACN-methyl-N-[(1-methylpyrrolidin-2-yl)methyl]-3-piperidin-2-ylpropanamide
SMILESCN(CC1CCCN1C)C(=O)CCC1CCCCN1
InChIInChI=1S/C15H29N3O/c1-17-11-5-7-14(17)12-18(2)15(19)9-8-13-6-3-4-10-16-13/h13-14,16H,3-12H2,1-2H3
InChIKeyILQYINMGGRDTBX-UHFFFAOYSA-N
MW267.42 g/mol
LogP1.46
Rot. Bonds5

About N-methyl-N-[(1-methylpyrrolidin-2-yl)methyl]-3-piperidin-2-ylpropanamide

N-methyl-N-[(1-methylpyrrolidin-2-yl)methyl]-3-piperidin-2-ylpropanamide (PubChem CID 79314839) has the molecular formula C15H29N3O and a molecular weight of 267.42 g/mol. Its IUPAC name is N-methyl-N-[(1-methylpyrrolidin-2-yl)methyl]-3-piperidin-2-ylpropanamide.

Molecular Properties

Compound NameN-methyl-N-[(1-methylpyrrolidin-2-yl)methyl]-3-piperidin-2-ylpropanamide
PubChem CID79314839
Molecular FormulaC15H29N3O
Molecular Weight267.42 g/mol
Exact Mass267.23
IUPAC NameN-methyl-N-[(1-methylpyrrolidin-2-yl)methyl]-3-piperidin-2-ylpropanamide
SMILESCN(CC1CCCN1C)C(=O)CCC1CCCCN1
InChIInChI=1S/C15H29N3O/c1-17-11-5-7-14(17)12-18(2)15(19)9-8-13-6-3-4-10-16-13/h13-14,16H,3-12H2,1-2H3
InChIKeyILQYINMGGRDTBX-UHFFFAOYSA-N
XLogP1.46
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.42
LogP ≤ 51.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-N-[(1-methylpyrrolidin-2-yl)methyl]-3-piperidin-3-ylpropanamide
CID 79313736
N-methyl-N-[(1-methylpyrrolidin-2-yl)methyl]-1-piperidin-2-ylmethanamine
CID 79314836
N-methyl-N-[(1-methylpyrrolidin-2-yl)methyl]azepane-2-carboxamide
CID 79314390
N-methyl-N-(oxan-2-ylmethyl)-3-piperidin-2-ylpropanamide
CID 62211472
N-methyl-3-(methylamino)-N-[(1-methylpyrrolidin-2-yl)methyl]propanamide
CID 79314488
2-(1,1-dioxo-1,4-thiazinan-3-yl)-N-methyl-N-[(1-methylpyrrolidin-2-yl)methyl]acetamide
CID 80522002
N-butyl-N-methyl-3-piperidin-2-ylpropanamide
CID 62210320
5-amino-N-methyl-N-[(1-methylpyrrolidin-2-yl)methyl]pentanamide
CID 79314072
N-methyl-N-[(1-methylpyrrolidin-2-yl)methyl]-3-(propan-2-ylamino)propanamide
CID 79313817
3-cyclohexyl-N-methyl-N-(2-piperidin-2-ylethyl)propanamide
CID 43187165
N,2-dimethyl-N-[(1-methylpyrrolidin-2-yl)methyl]propanamide
CID 79312888
2-[methyl-[(1-methylpyrrolidin-2-yl)methyl]amino]-2-oxoacetic acid
CID 79315922

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[(1-methylpyrrolidin-2-yl)methyl]-3-piperidin-2-ylpropanamide?
The IUPAC name of N-methyl-N-[(1-methylpyrrolidin-2-yl)methyl]-3-piperidin-2-ylpropanamide (CID 79314839) is N-methyl-N-[(1-methylpyrrolidin-2-yl)methyl]-3-piperidin-2-ylpropanamide.
What is the SMILES notation for N-methyl-N-[(1-methylpyrrolidin-2-yl)methyl]-3-piperidin-2-ylpropanamide?
The canonical SMILES for N-methyl-N-[(1-methylpyrrolidin-2-yl)methyl]-3-piperidin-2-ylpropanamide is CN(CC1CCCN1C)C(=O)CCC1CCCCN1.
What is the InChIKey of N-methyl-N-[(1-methylpyrrolidin-2-yl)methyl]-3-piperidin-2-ylpropanamide?
The InChIKey is ILQYINMGGRDTBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29N3O/c1-17-11-5-7-14(17)12-18(2)15(19)9-8-13-6-3-4-10-16-13/h13-14,16H,3-12H2,1-2H3.
What are the key properties of N-methyl-N-[(1-methylpyrrolidin-2-yl)methyl]-3-piperidin-2-ylpropanamide?
N-methyl-N-[(1-methylpyrrolidin-2-yl)methyl]-3-piperidin-2-ylpropanamide has a molecular weight of 267.42 g/mol, XLogP of 1.46, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[(1-methylpyrrolidin-2-yl)methyl]-3-piperidin-2-ylpropanamide is sourced from PubChem (CID 79314839), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).