N-[[1-(3-methylpyrrolidine-2-carbonyl)piperidin-4-yl]methyl]acetamide

C14H25N3O2 — CID 102780192

IUPACN-[[1-(3-methylpyrrolidine-2-carbonyl)piperidin-4-yl]methyl]acetamide
SMILESCC(=O)NCC1CCN(C(=O)C2NCCC2C)CC1
InChIInChI=1S/C14H25N3O2/c1-10-3-6-15-13(10)14(19)17-7-4-12(5-8-17)9-16-11(2)18/h10,12-13,15H,3-9H2,1-2H3,(H,16,18)
InChIKeyXWBQSBWDTJQPNC-UHFFFAOYSA-N
MW267.37 g/mol
LogP0.36
Rot. Bonds3

About N-[[1-(3-methylpyrrolidine-2-carbonyl)piperidin-4-yl]methyl]acetamide

N-[[1-(3-methylpyrrolidine-2-carbonyl)piperidin-4-yl]methyl]acetamide (PubChem CID 102780192) has the molecular formula C14H25N3O2 and a molecular weight of 267.37 g/mol. Its IUPAC name is N-[[1-(3-methylpyrrolidine-2-carbonyl)piperidin-4-yl]methyl]acetamide.

Molecular Properties

Compound NameN-[[1-(3-methylpyrrolidine-2-carbonyl)piperidin-4-yl]methyl]acetamide
PubChem CID102780192
Molecular FormulaC14H25N3O2
Molecular Weight267.37 g/mol
Exact Mass267.19
IUPAC NameN-[[1-(3-methylpyrrolidine-2-carbonyl)piperidin-4-yl]methyl]acetamide
SMILESCC(=O)NCC1CCN(C(=O)C2NCCC2C)CC1
InChIInChI=1S/C14H25N3O2/c1-10-3-6-15-13(10)14(19)17-7-4-12(5-8-17)9-16-11(2)18/h10,12-13,15H,3-9H2,1-2H3,(H,16,18)
InChIKeyXWBQSBWDTJQPNC-UHFFFAOYSA-N
XLogP0.36
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.37
LogP ≤ 50.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(3-ethylpyrrolidin-1-yl)-(3-methylpyrrolidin-2-yl)methanone
CID 102780010
(3-methylpyrrolidin-2-yl)-pyrrolidin-1-ylmethanone
CID 85176427
cis-(1S,2R)-2-[4-(acetamidomethyl)piperidine-1-carbonyl]cyclopropane-1-carboxylic acid
CID 114093135
N-[[1-(4-methylpiperidine-1-carbonyl)piperidin-4-yl]methyl]acetamide
CID 102736162
[4-[[butyl(methyl)amino]methyl]piperidin-1-yl]-(3-methylpyrrolidin-2-yl)methanone
CID 102778861
N-(cyclobutylmethyl)-3-methylpyrrolidine-2-carboxamide
CID 102777267
(4-methoxypiperidin-1-yl)-(3-methylpiperidin-2-yl)methanone
CID 62339458
N,N-dimethyl-1-(3-methylpyrrolidine-2-carbonyl)piperidine-4-carboxamide
CID 102778682
(3-methylpiperidin-2-yl)-[4-(pyrrolidin-1-ylmethyl)piperidin-1-yl]methanone
CID 63007381
N-[(1-piperidin-4-ylpiperidin-4-yl)methyl]acetamide
CID 102736375
3-[4-(acetamidomethyl)piperidin-1-yl]-3-oxopropanoic acid
CID 102736982
N-[[1-[(1S,3S)-2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropanecarbonyl]piperidin-4-yl]methyl]acetamide
CID 94182591

Frequently Asked Questions

What is the IUPAC name of N-[[1-(3-methylpyrrolidine-2-carbonyl)piperidin-4-yl]methyl]acetamide?
The IUPAC name of N-[[1-(3-methylpyrrolidine-2-carbonyl)piperidin-4-yl]methyl]acetamide (CID 102780192) is N-[[1-(3-methylpyrrolidine-2-carbonyl)piperidin-4-yl]methyl]acetamide.
What is the SMILES notation for N-[[1-(3-methylpyrrolidine-2-carbonyl)piperidin-4-yl]methyl]acetamide?
The canonical SMILES for N-[[1-(3-methylpyrrolidine-2-carbonyl)piperidin-4-yl]methyl]acetamide is CC(=O)NCC1CCN(C(=O)C2NCCC2C)CC1.
What is the InChIKey of N-[[1-(3-methylpyrrolidine-2-carbonyl)piperidin-4-yl]methyl]acetamide?
The InChIKey is XWBQSBWDTJQPNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3O2/c1-10-3-6-15-13(10)14(19)17-7-4-12(5-8-17)9-16-11(2)18/h10,12-13,15H,3-9H2,1-2H3,(H,16,18).
What are the key properties of N-[[1-(3-methylpyrrolidine-2-carbonyl)piperidin-4-yl]methyl]acetamide?
N-[[1-(3-methylpyrrolidine-2-carbonyl)piperidin-4-yl]methyl]acetamide has a molecular weight of 267.37 g/mol, XLogP of 0.36, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(3-methylpyrrolidine-2-carbonyl)piperidin-4-yl]methyl]acetamide is sourced from PubChem (CID 102780192), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).