1-N,1-N-dimethyl-4-N-propan-2-ylpiperidine-1,4-dicarboxamide

C12H23N3O2 — CID 3235986

IUPAC1-N,1-N-dimethyl-4-N-propan-2-ylpiperidine-1,4-dicarboxamide
SMILESCC(C)NC(=O)C1CCN(C(=O)N(C)C)CC1
InChIInChI=1S/C12H23N3O2/c1-9(2)13-11(16)10-5-7-15(8-6-10)12(17)14(3)4/h9-10H,5-8H2,1-4H3,(H,13,16)
InChIKeyFUIHRZVHFQQWKU-UHFFFAOYSA-N
MW241.33 g/mol
LogP0.90
Rot. Bonds2

About 1-N,1-N-dimethyl-4-N-propan-2-ylpiperidine-1,4-dicarboxamide

1-N,1-N-dimethyl-4-N-propan-2-ylpiperidine-1,4-dicarboxamide (PubChem CID 3235986) has the molecular formula C12H23N3O2 and a molecular weight of 241.33 g/mol. Its IUPAC name is 1-N,1-N-dimethyl-4-N-propan-2-ylpiperidine-1,4-dicarboxamide.

Molecular Properties

Compound Name1-N,1-N-dimethyl-4-N-propan-2-ylpiperidine-1,4-dicarboxamide
PubChem CID3235986
Molecular FormulaC12H23N3O2
Molecular Weight241.33 g/mol
Exact Mass241.18
IUPAC Name1-N,1-N-dimethyl-4-N-propan-2-ylpiperidine-1,4-dicarboxamide
SMILESCC(C)NC(=O)C1CCN(C(=O)N(C)C)CC1
InChIInChI=1S/C12H23N3O2/c1-9(2)13-11(16)10-5-7-15(8-6-10)12(17)14(3)4/h9-10H,5-8H2,1-4H3,(H,13,16)
InChIKeyFUIHRZVHFQQWKU-UHFFFAOYSA-N
XLogP0.90
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.33
LogP ≤ 50.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-Cycloheptyl-3-[1-(2-methylbutanoyl)piperidin-4-yl]urea
CID 71678007
N,N-Diethyl-4-piperidinecarboxamide
CID 410920
N,N-dimethylpiperidine-4-carboxamide
CID 411689
N~1~-propylpiperidine-1,3-dicarboxamide
CID 2952083
1-Cyclohexyl-3-[1-(2-methylbutanoyl)piperidin-4-yl]urea
CID 71678006
N-[3-(dimethylamino)propyl]piperidine-4-carboxamide
CID 2186960
N~4~-cyclooctyl-N~1~,N~1~-dimethylpiperidine-1,4-dicarboxamide
CID 3236588
1-acetyl-N-(1-propylpiperidin-4-yl)piperidine-4-carboxamide
CID 6467229
N~4~-(3-ethoxypropyl)-N~1~,N~1~-dimethylpiperidine-1,4-dicarboxamide
CID 3236681
N~4~-(sec-butyl)-N~1~,N~1~-dimethylpiperidine-1,4-dicarboxamide
CID 3239385
N~1~,N~1~-dimethyl-N~4~-(3-methylbutyl)piperidine-1,4-dicarboxamide
CID 3243850
N-((1-isopropylpiperidin-4-yl)methyl)isobutyramide
CID 16895472

Frequently Asked Questions

What is the IUPAC name of 1-N,1-N-dimethyl-4-N-propan-2-ylpiperidine-1,4-dicarboxamide?
The IUPAC name of 1-N,1-N-dimethyl-4-N-propan-2-ylpiperidine-1,4-dicarboxamide (CID 3235986) is 1-N,1-N-dimethyl-4-N-propan-2-ylpiperidine-1,4-dicarboxamide.
What is the SMILES notation for 1-N,1-N-dimethyl-4-N-propan-2-ylpiperidine-1,4-dicarboxamide?
The canonical SMILES for 1-N,1-N-dimethyl-4-N-propan-2-ylpiperidine-1,4-dicarboxamide is CC(C)NC(=O)C1CCN(C(=O)N(C)C)CC1.
What is the InChIKey of 1-N,1-N-dimethyl-4-N-propan-2-ylpiperidine-1,4-dicarboxamide?
The InChIKey is FUIHRZVHFQQWKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N3O2/c1-9(2)13-11(16)10-5-7-15(8-6-10)12(17)14(3)4/h9-10H,5-8H2,1-4H3,(H,13,16).
What are the key properties of 1-N,1-N-dimethyl-4-N-propan-2-ylpiperidine-1,4-dicarboxamide?
1-N,1-N-dimethyl-4-N-propan-2-ylpiperidine-1,4-dicarboxamide has a molecular weight of 241.33 g/mol, XLogP of 0.90, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N,1-N-dimethyl-4-N-propan-2-ylpiperidine-1,4-dicarboxamide is sourced from PubChem (CID 3235986), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).