3-amino-N-(1-pyrimidin-2-ylpiperidin-3-yl)oxolane-3-carboxamide

C14H21N5O2 — CID 64892126

IUPAC3-amino-N-(1-pyrimidin-2-ylpiperidin-3-yl)oxolane-3-carboxamide
SMILESNC1(C(=O)NC2CCCN(c3ncccn3)C2)CCOC1
InChIInChI=1S/C14H21N5O2/c15-14(4-8-21-10-14)12(20)18-11-3-1-7-19(9-11)13-16-5-2-6-17-13/h2,5-6,11H,1,3-4,7-10,15H2,(H,18,20)
InChIKeyLUZYOYYYOURZCR-UHFFFAOYSA-N
MW291.35 g/mol
LogP-0.32
Rot. Bonds3

About 3-amino-N-(1-pyrimidin-2-ylpiperidin-3-yl)oxolane-3-carboxamide

3-amino-N-(1-pyrimidin-2-ylpiperidin-3-yl)oxolane-3-carboxamide (PubChem CID 64892126) has the molecular formula C14H21N5O2 and a molecular weight of 291.35 g/mol. Its IUPAC name is 3-amino-N-(1-pyrimidin-2-ylpiperidin-3-yl)oxolane-3-carboxamide.

Molecular Properties

Compound Name3-amino-N-(1-pyrimidin-2-ylpiperidin-3-yl)oxolane-3-carboxamide
PubChem CID64892126
Molecular FormulaC14H21N5O2
Molecular Weight291.35 g/mol
Exact Mass291.17
IUPAC Name3-amino-N-(1-pyrimidin-2-ylpiperidin-3-yl)oxolane-3-carboxamide
SMILESNC1(C(=O)NC2CCCN(c3ncccn3)C2)CCOC1
InChIInChI=1S/C14H21N5O2/c15-14(4-8-21-10-14)12(20)18-11-3-1-7-19(9-11)13-16-5-2-6-17-13/h2,5-6,11H,1,3-4,7-10,15H2,(H,18,20)
InChIKeyLUZYOYYYOURZCR-UHFFFAOYSA-N
XLogP-0.32
TPSA93.37 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.35
LogP ≤ 5-0.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

1-(4-methoxyphenyl)-N-[(3R)-1-pyrimidin-2-ylpiperidin-3-yl]cyclopropane-1-carboxamide
CID 95713073
(2S)-2-amino-N-(1-pyrimidin-2-ylpiperidin-3-yl)butanamide
CID 79024327
(2R)-2-amino-N-(1-pyrimidin-2-ylpiperidin-3-yl)propanamide;dihydrochloride
CID 119857933
4-pyrazol-1-yl-N-(1-pyrimidin-2-ylpiperidin-3-yl)piperidine-4-carboxamide;dihydrochloride
CID 120939658
2-(1-adamantyl)-N-[(3S)-1-pyrimidin-2-ylpiperidin-3-yl]acetamide
CID 94100426
3-amino-N-(1-methyl-6-oxopiperidin-3-yl)oxolane-3-carboxamide
CID 64893018
3-amino-2-methyl-N-(1-pyrimidin-2-ylpiperidin-3-yl)butanamide;dihydrochloride
CID 120503187
1-[(4-morpholin-4-ylsulfonylphenyl)methyl]-3-(1-pyrimidin-2-ylpiperidin-3-yl)urea
CID 55768855
1-[[(3S)-oxolan-3-yl]methyl]-3-[(3R)-1-pyrimidin-2-ylpiperidin-3-yl]urea
CID 94124298
(3R)-N-cyclopropyl-1-pyrimidin-2-ylpiperidine-3-carboxamide
CID 6557829
2-amino-2-cyclopropyl-N-(1-pyrimidin-2-ylpiperidin-3-yl)propanamide
CID 60866816
2-naphthalen-2-yl-N-[(3R)-1-pyrimidin-2-ylpiperidin-3-yl]acetamide
CID 94100658

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(1-pyrimidin-2-ylpiperidin-3-yl)oxolane-3-carboxamide?
The IUPAC name of 3-amino-N-(1-pyrimidin-2-ylpiperidin-3-yl)oxolane-3-carboxamide (CID 64892126) is 3-amino-N-(1-pyrimidin-2-ylpiperidin-3-yl)oxolane-3-carboxamide.
What is the SMILES notation for 3-amino-N-(1-pyrimidin-2-ylpiperidin-3-yl)oxolane-3-carboxamide?
The canonical SMILES for 3-amino-N-(1-pyrimidin-2-ylpiperidin-3-yl)oxolane-3-carboxamide is NC1(C(=O)NC2CCCN(c3ncccn3)C2)CCOC1.
What is the InChIKey of 3-amino-N-(1-pyrimidin-2-ylpiperidin-3-yl)oxolane-3-carboxamide?
The InChIKey is LUZYOYYYOURZCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N5O2/c15-14(4-8-21-10-14)12(20)18-11-3-1-7-19(9-11)13-16-5-2-6-17-13/h2,5-6,11H,1,3-4,7-10,15H2,(H,18,20).
What are the key properties of 3-amino-N-(1-pyrimidin-2-ylpiperidin-3-yl)oxolane-3-carboxamide?
3-amino-N-(1-pyrimidin-2-ylpiperidin-3-yl)oxolane-3-carboxamide has a molecular weight of 291.35 g/mol, XLogP of -0.32, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(1-pyrimidin-2-ylpiperidin-3-yl)oxolane-3-carboxamide is sourced from PubChem (CID 64892126), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).