N-(oxan-2-ylmethyl)piperidine-1-carboxamide

C12H22N2O2 — CID 67299509

IUPACN-(oxan-2-ylmethyl)piperidine-1-carboxamide
SMILESO=C(NCC1CCCCO1)N1CCCCC1
InChIInChI=1S/C12H22N2O2/c15-12(14-7-3-1-4-8-14)13-10-11-6-2-5-9-16-11/h11H,1-10H2,(H,13,15)
InChIKeyGQIZQILQWGBMPG-UHFFFAOYSA-N
MW226.32 g/mol
LogP1.75
Rot. Bonds2

About N-(oxan-2-ylmethyl)piperidine-1-carboxamide

N-(oxan-2-ylmethyl)piperidine-1-carboxamide (PubChem CID 67299509) has the molecular formula C12H22N2O2 and a molecular weight of 226.32 g/mol. Its IUPAC name is N-(oxan-2-ylmethyl)piperidine-1-carboxamide.

Molecular Properties

Compound NameN-(oxan-2-ylmethyl)piperidine-1-carboxamide
PubChem CID67299509
Molecular FormulaC12H22N2O2
Molecular Weight226.32 g/mol
Exact Mass226.17
IUPAC NameN-(oxan-2-ylmethyl)piperidine-1-carboxamide
SMILESO=C(NCC1CCCCO1)N1CCCCC1
InChIInChI=1S/C12H22N2O2/c15-12(14-7-3-1-4-8-14)13-10-11-6-2-5-9-16-11/h11H,1-10H2,(H,13,15)
InChIKeyGQIZQILQWGBMPG-UHFFFAOYSA-N
XLogP1.75
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.32
LogP ≤ 51.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-(N-(Cyclohexyl)carbamoyl)morpholine
CID 853662
N,N'-Hexamethylenebis(4-carbamoylmorpholine)
CID 3525281
N-[(Oxolan-2-yl)methyl]morpholine-4-carboxamide
CID 3311551
4-methoxy-N-(2-methoxyethyl)piperidine-1-carboxamide
CID 145915642
(2S,6R)-2,6-dimethyl-N-(4-propan-2-yloxybutyl)morpholine-4-carboxamide
CID 75502454
N,N-dimethyl-4-(oxan-2-ylmethyl)piperazine-1-carboxamide
CID 86768181
N-{[(2R)-oxolan-2-yl]methyl}morpholine-4-carboxamide
CID 735630
3-[1-(2,2-Difluoroethyl)piperidin-4-yl]-1-(oxan-2-ylmethyl)-1-propylurea
CID 56782093
3-[1-(2,2-difluoroethyl)piperidin-4-yl]-1-[[(2S)-oxan-2-yl]methyl]-1-propylurea
CID 95614220
3-[1-(2,2-difluoroethyl)piperidin-4-yl]-1-[[(2R)-oxan-2-yl]methyl]-1-propylurea
CID 95614221
(2S,6R)-N-cyclohexyl-2,6-dimethylmorpholine-4-carboxamide
CID 92642305
N-cyclohexyl-2,6-dimethyl-4-morpholinecarboxamide
CID 3613777

Frequently Asked Questions

What is the IUPAC name of N-(oxan-2-ylmethyl)piperidine-1-carboxamide?
The IUPAC name of N-(oxan-2-ylmethyl)piperidine-1-carboxamide (CID 67299509) is N-(oxan-2-ylmethyl)piperidine-1-carboxamide.
What is the SMILES notation for N-(oxan-2-ylmethyl)piperidine-1-carboxamide?
The canonical SMILES for N-(oxan-2-ylmethyl)piperidine-1-carboxamide is O=C(NCC1CCCCO1)N1CCCCC1.
What is the InChIKey of N-(oxan-2-ylmethyl)piperidine-1-carboxamide?
The InChIKey is GQIZQILQWGBMPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2O2/c15-12(14-7-3-1-4-8-14)13-10-11-6-2-5-9-16-11/h11H,1-10H2,(H,13,15).
What are the key properties of N-(oxan-2-ylmethyl)piperidine-1-carboxamide?
N-(oxan-2-ylmethyl)piperidine-1-carboxamide has a molecular weight of 226.32 g/mol, XLogP of 1.75, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(oxan-2-ylmethyl)piperidine-1-carboxamide is sourced from PubChem (CID 67299509), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).