1-[1-(cyclopropanecarbonyl)piperidin-4-yl]-N-methyl-N-(2-methylpropyl)piperidine-3-carboxamide

C20H35N3O2 — CID 45182085

IUPAC1-[1-(cyclopropanecarbonyl)piperidin-4-yl]-N-methyl-N-(2-methylpropyl)piperidine-3-carboxamide
SMILESCC(C)CN(C)C(=O)C1CCCN(C2CCN(C(=O)C3CC3)CC2)C1
InChIInChI=1S/C20H35N3O2/c1-15(2)13-21(3)19(24)17-5-4-10-23(14-17)18-8-11-22(12-9-18)20(25)16-6-7-16/h15-18H,4-14H2,1-3H3
InChIKeyZZDVWGNLRWLHAJ-UHFFFAOYSA-N
MW349.52 g/mol
LogP2.21
Rot. Bonds5

About 1-[1-(cyclopropanecarbonyl)piperidin-4-yl]-N-methyl-N-(2-methylpropyl)piperidine-3-carboxamide

1-[1-(cyclopropanecarbonyl)piperidin-4-yl]-N-methyl-N-(2-methylpropyl)piperidine-3-carboxamide (PubChem CID 45182085) has the molecular formula C20H35N3O2 and a molecular weight of 349.52 g/mol. Its IUPAC name is 1-[1-(cyclopropanecarbonyl)piperidin-4-yl]-N-methyl-N-(2-methylpropyl)piperidine-3-carboxamide.

Molecular Properties

Compound Name1-[1-(cyclopropanecarbonyl)piperidin-4-yl]-N-methyl-N-(2-methylpropyl)piperidine-3-carboxamide
PubChem CID45182085
Molecular FormulaC20H35N3O2
Molecular Weight349.52 g/mol
Exact Mass349.27
IUPAC Name1-[1-(cyclopropanecarbonyl)piperidin-4-yl]-N-methyl-N-(2-methylpropyl)piperidine-3-carboxamide
SMILESCC(C)CN(C)C(=O)C1CCCN(C2CCN(C(=O)C3CC3)CC2)C1
InChIInChI=1S/C20H35N3O2/c1-15(2)13-21(3)19(24)17-5-4-10-23(14-17)18-8-11-22(12-9-18)20(25)16-6-7-16/h15-18H,4-14H2,1-3H3
InChIKeyZZDVWGNLRWLHAJ-UHFFFAOYSA-N
XLogP2.21
TPSA43.86 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.52
LogP ≤ 52.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1,5-Bis(3-methylpiperidin-1-yl)pentane-1,5-dione
CID 4576685
N-cyclohexyl-1-cyclopropyl-N-methyl-6-oxo-3-piperidinecarboxamide
CID 24791436
1,1'-(Hexane-1,6-diyl)bis(N,N-diethylpiperidine-3-carboxamide)--hydrogen bromide (1/2)
CID 121328
Ketone, 1-methyl-3-piperidyl piperidino
CID 218423
1-Cycloheptyl-5-(4-propan-2-ylpiperidine-1-carbonyl)piperidin-2-one
CID 45190930
Nipecotamide, N,N'-ethylenebis(N-butyl-1-methyl-
CID 218425
1,6-bis(3-(N,N-diethylcarbamoyl)piperidino)hexane
CID 121329
1,1'-(1,10-Decanediyl)bis(N,N-diethyl-3-piperidinecarboxamide)
CID 121331
Cambridge id 5465862
CID 2846715
1-[1-[1-(Cyclopropanecarbonyl)piperidine-3-carbonyl]piperidin-4-yl]pyrrolidin-2-one
CID 134796573
N,N'-(Ethane-1,2-diyl)bis(1-hexyl-N-methylpiperidine-3-carboxamide)
CID 13300503
1,5-Bis(3,5-dimethylpiperidin-1-yl)pentane-1,5-dione
CID 2931016

Frequently Asked Questions

What is the IUPAC name of 1-[1-(cyclopropanecarbonyl)piperidin-4-yl]-N-methyl-N-(2-methylpropyl)piperidine-3-carboxamide?
The IUPAC name of 1-[1-(cyclopropanecarbonyl)piperidin-4-yl]-N-methyl-N-(2-methylpropyl)piperidine-3-carboxamide (CID 45182085) is 1-[1-(cyclopropanecarbonyl)piperidin-4-yl]-N-methyl-N-(2-methylpropyl)piperidine-3-carboxamide.
What is the SMILES notation for 1-[1-(cyclopropanecarbonyl)piperidin-4-yl]-N-methyl-N-(2-methylpropyl)piperidine-3-carboxamide?
The canonical SMILES for 1-[1-(cyclopropanecarbonyl)piperidin-4-yl]-N-methyl-N-(2-methylpropyl)piperidine-3-carboxamide is CC(C)CN(C)C(=O)C1CCCN(C2CCN(C(=O)C3CC3)CC2)C1.
What is the InChIKey of 1-[1-(cyclopropanecarbonyl)piperidin-4-yl]-N-methyl-N-(2-methylpropyl)piperidine-3-carboxamide?
The InChIKey is ZZDVWGNLRWLHAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H35N3O2/c1-15(2)13-21(3)19(24)17-5-4-10-23(14-17)18-8-11-22(12-9-18)20(25)16-6-7-16/h15-18H,4-14H2,1-3H3.
What are the key properties of 1-[1-(cyclopropanecarbonyl)piperidin-4-yl]-N-methyl-N-(2-methylpropyl)piperidine-3-carboxamide?
1-[1-(cyclopropanecarbonyl)piperidin-4-yl]-N-methyl-N-(2-methylpropyl)piperidine-3-carboxamide has a molecular weight of 349.52 g/mol, XLogP of 2.21, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(cyclopropanecarbonyl)piperidin-4-yl]-N-methyl-N-(2-methylpropyl)piperidine-3-carboxamide is sourced from PubChem (CID 45182085), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).