N-(2-methylpropyl)-2-[4-(piperidine-1-carbonyl)piperidin-1-yl]acetamide

C17H31N3O2 — CID 78788315

IUPACN-(2-methylpropyl)-2-[4-(piperidine-1-carbonyl)piperidin-1-yl]acetamide
SMILESCC(C)CNC(=O)CN1CCC(C(=O)N2CCCCC2)CC1
InChIInChI=1S/C17H31N3O2/c1-14(2)12-18-16(21)13-19-10-6-15(7-11-19)17(22)20-8-4-3-5-9-20/h14-15H,3-13H2,1-2H3,(H,18,21)
InChIKeyBNWKSHUBQXTRPB-UHFFFAOYSA-N
MW309.45 g/mol
LogP1.48
Rot. Bonds5

About N-(2-methylpropyl)-2-[4-(piperidine-1-carbonyl)piperidin-1-yl]acetamide

N-(2-methylpropyl)-2-[4-(piperidine-1-carbonyl)piperidin-1-yl]acetamide (PubChem CID 78788315) has the molecular formula C17H31N3O2 and a molecular weight of 309.45 g/mol. Its IUPAC name is N-(2-methylpropyl)-2-[4-(piperidine-1-carbonyl)piperidin-1-yl]acetamide.

Molecular Properties

Compound NameN-(2-methylpropyl)-2-[4-(piperidine-1-carbonyl)piperidin-1-yl]acetamide
PubChem CID78788315
Molecular FormulaC17H31N3O2
Molecular Weight309.45 g/mol
Exact Mass309.24
IUPAC NameN-(2-methylpropyl)-2-[4-(piperidine-1-carbonyl)piperidin-1-yl]acetamide
SMILESCC(C)CNC(=O)CN1CCC(C(=O)N2CCCCC2)CC1
InChIInChI=1S/C17H31N3O2/c1-14(2)12-18-16(21)13-19-10-6-15(7-11-19)17(22)20-8-4-3-5-9-20/h14-15H,3-13H2,1-2H3,(H,18,21)
InChIKeyBNWKSHUBQXTRPB-UHFFFAOYSA-N
XLogP1.48
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.45
LogP ≤ 51.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(cyclohexylmethyl)-2-[4-(piperidine-1-carbonyl)piperidin-1-yl]acetamide
CID 86908445
N-(2-methoxyethyl)-2-[4-(piperidine-1-carbonyl)piperidin-1-yl]acetamide
CID 51072787
N-(2-methylpropyl)-2-[(2R)-2-(pyrrolidine-1-carbonyl)piperidin-1-yl]acetamide
CID 94778620
N-cyclopropyl-2-[4-(pyrrolidine-1-carbonyl)piperidin-1-yl]acetamide
CID 134058309
N-(3-cyclohexyloxypropyl)-2-[4-(pyrrolidine-1-carbonyl)piperidin-1-yl]acetamide
CID 87015240
N-heptan-2-yl-2-[4-(pyrrolidine-1-carbonyl)piperidin-1-yl]acetamide
CID 134058350
2-[4-(azepane-1-carbonyl)piperidin-1-yl]-N-[(1R)-1-naphthalen-1-ylethyl]acetamide
CID 41104934
2-[4-(azepane-1-carbonyl)piperidin-1-yl]-N-[(1S)-1-(4-phenylphenyl)ethyl]acetamide
CID 40895557
2-[4-(azepane-1-carbonyl)piperidin-1-yl]-N-(2-cyano-3-methylbutan-2-yl)acetamide
CID 51227036
2-[(3S)-3-hydroxypyrrolidin-1-yl]-N-(2-methylpropyl)acetamide
CID 78930704
N-(2-cyano-3-methylbutan-2-yl)-2-[4-(pyrrolidine-1-carbonyl)piperidin-1-yl]acetamide
CID 51287537
2-[4-(azepane-1-carbonyl)piperidin-1-yl]-N-[1-(4-fluorophenyl)-2-methylpropyl]acetamide
CID 55468968

Frequently Asked Questions

What is the IUPAC name of N-(2-methylpropyl)-2-[4-(piperidine-1-carbonyl)piperidin-1-yl]acetamide?
The IUPAC name of N-(2-methylpropyl)-2-[4-(piperidine-1-carbonyl)piperidin-1-yl]acetamide (CID 78788315) is N-(2-methylpropyl)-2-[4-(piperidine-1-carbonyl)piperidin-1-yl]acetamide.
What is the SMILES notation for N-(2-methylpropyl)-2-[4-(piperidine-1-carbonyl)piperidin-1-yl]acetamide?
The canonical SMILES for N-(2-methylpropyl)-2-[4-(piperidine-1-carbonyl)piperidin-1-yl]acetamide is CC(C)CNC(=O)CN1CCC(C(=O)N2CCCCC2)CC1.
What is the InChIKey of N-(2-methylpropyl)-2-[4-(piperidine-1-carbonyl)piperidin-1-yl]acetamide?
The InChIKey is BNWKSHUBQXTRPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H31N3O2/c1-14(2)12-18-16(21)13-19-10-6-15(7-11-19)17(22)20-8-4-3-5-9-20/h14-15H,3-13H2,1-2H3,(H,18,21).
What are the key properties of N-(2-methylpropyl)-2-[4-(piperidine-1-carbonyl)piperidin-1-yl]acetamide?
N-(2-methylpropyl)-2-[4-(piperidine-1-carbonyl)piperidin-1-yl]acetamide has a molecular weight of 309.45 g/mol, XLogP of 1.48, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylpropyl)-2-[4-(piperidine-1-carbonyl)piperidin-1-yl]acetamide is sourced from PubChem (CID 78788315), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).