N-propan-2-yl-1-(1-propan-2-ylpiperidin-4-yl)piperidine-4-carboxamide

C17H33N3O — CID 28955653

IUPACN-propan-2-yl-1-(1-propan-2-ylpiperidin-4-yl)piperidine-4-carboxamide
SMILESCC(C)NC(=O)C1CCN(C2CCN(C(C)C)CC2)CC1
InChIInChI=1S/C17H33N3O/c1-13(2)18-17(21)15-5-9-20(10-6-15)16-7-11-19(12-8-16)14(3)4/h13-16H,5-12H2,1-4H3,(H,18,21)
InChIKeyANJKSIMCWKBGFG-UHFFFAOYSA-N
MW295.47 g/mol
LogP2.10
Rot. Bonds4

About N-propan-2-yl-1-(1-propan-2-ylpiperidin-4-yl)piperidine-4-carboxamide

N-propan-2-yl-1-(1-propan-2-ylpiperidin-4-yl)piperidine-4-carboxamide (PubChem CID 28955653) has the molecular formula C17H33N3O and a molecular weight of 295.47 g/mol. Its IUPAC name is N-propan-2-yl-1-(1-propan-2-ylpiperidin-4-yl)piperidine-4-carboxamide.

Molecular Properties

Compound NameN-propan-2-yl-1-(1-propan-2-ylpiperidin-4-yl)piperidine-4-carboxamide
PubChem CID28955653
Molecular FormulaC17H33N3O
Molecular Weight295.47 g/mol
Exact Mass295.26
IUPAC NameN-propan-2-yl-1-(1-propan-2-ylpiperidin-4-yl)piperidine-4-carboxamide
SMILESCC(C)NC(=O)C1CCN(C2CCN(C(C)C)CC2)CC1
InChIInChI=1S/C17H33N3O/c1-13(2)18-17(21)15-5-9-20(10-6-15)16-7-11-19(12-8-16)14(3)4/h13-16H,5-12H2,1-4H3,(H,18,21)
InChIKeyANJKSIMCWKBGFG-UHFFFAOYSA-N
XLogP2.10
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.47
LogP ≤ 52.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-fluoro-1-[1-(1-propan-2-ylpiperidin-4-yl)piperidin-4-yl]ethanone
CID 170144751
ethane;1-(1-propan-2-ylpiperidin-4-yl)ethanone
CID 177135939
4-(azetidin-1-yl)-1-propan-2-ylpiperidine
CID 21054794
ethane;(1-methylpiperidin-4-yl)-[4-(1-propan-2-ylpiperidin-4-yl)piperazin-1-yl]methanone
CID 176568951
2-(4-pyrrolidin-1-ylpiperidin-1-yl)propanoic acid
CID 121201886
1-[1-(2-fluorobenzoyl)piperidin-4-yl]-N-propan-2-ylpiperidine-4-carboxamide
CID 42114058
N-(1-methoxypropan-2-yl)-1-propan-2-ylpiperidine-4-carboxamide
CID 167004447
N-propan-2-yl-1-[1-(2-pyridin-4-ylacetyl)piperidin-4-yl]piperidine-4-carboxamide
CID 26400411
N-tert-butyl-1-propan-2-ylpiperidine-4-carboxamide
CID 155453359
4-piperidin-1-yl-N-propan-2-ylpiperidine-1-carboxamide
CID 115582950
1-(1-propan-2-ylpiperidin-4-yl)-N-(pyridin-3-ylmethyl)piperidine-4-carboxamide
CID 31042688
N-propan-2-yl-4-(pyrrolidine-1-carbonyl)cyclohexane-1-carboxamide
CID 109144455

Frequently Asked Questions

What is the IUPAC name of N-propan-2-yl-1-(1-propan-2-ylpiperidin-4-yl)piperidine-4-carboxamide?
The IUPAC name of N-propan-2-yl-1-(1-propan-2-ylpiperidin-4-yl)piperidine-4-carboxamide (CID 28955653) is N-propan-2-yl-1-(1-propan-2-ylpiperidin-4-yl)piperidine-4-carboxamide.
What is the SMILES notation for N-propan-2-yl-1-(1-propan-2-ylpiperidin-4-yl)piperidine-4-carboxamide?
The canonical SMILES for N-propan-2-yl-1-(1-propan-2-ylpiperidin-4-yl)piperidine-4-carboxamide is CC(C)NC(=O)C1CCN(C2CCN(C(C)C)CC2)CC1.
What is the InChIKey of N-propan-2-yl-1-(1-propan-2-ylpiperidin-4-yl)piperidine-4-carboxamide?
The InChIKey is ANJKSIMCWKBGFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H33N3O/c1-13(2)18-17(21)15-5-9-20(10-6-15)16-7-11-19(12-8-16)14(3)4/h13-16H,5-12H2,1-4H3,(H,18,21).
What are the key properties of N-propan-2-yl-1-(1-propan-2-ylpiperidin-4-yl)piperidine-4-carboxamide?
N-propan-2-yl-1-(1-propan-2-ylpiperidin-4-yl)piperidine-4-carboxamide has a molecular weight of 295.47 g/mol, XLogP of 2.10, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-propan-2-yl-1-(1-propan-2-ylpiperidin-4-yl)piperidine-4-carboxamide is sourced from PubChem (CID 28955653), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).