N-(morpholin-2-ylmethyl)pyrimidine-5-carboxamide

C10H14N4O2 — CID 102922356

IUPACN-(morpholin-2-ylmethyl)pyrimidine-5-carboxamide
SMILESO=C(NCC1CNCCO1)c1cncnc1
InChIInChI=1S/C10H14N4O2/c15-10(8-3-12-7-13-4-8)14-6-9-5-11-1-2-16-9/h3-4,7,9,11H,1-2,5-6H2,(H,14,15)
InChIKeyIDCSKAVQSGYHBK-UHFFFAOYSA-N
MW222.25 g/mol
LogP-0.81
Rot. Bonds3

About N-(morpholin-2-ylmethyl)pyrimidine-5-carboxamide

N-(morpholin-2-ylmethyl)pyrimidine-5-carboxamide (PubChem CID 102922356) has the molecular formula C10H14N4O2 and a molecular weight of 222.25 g/mol. Its IUPAC name is N-(morpholin-2-ylmethyl)pyrimidine-5-carboxamide.

Molecular Properties

Compound NameN-(morpholin-2-ylmethyl)pyrimidine-5-carboxamide
PubChem CID102922356
Molecular FormulaC10H14N4O2
Molecular Weight222.25 g/mol
Exact Mass222.11
IUPAC NameN-(morpholin-2-ylmethyl)pyrimidine-5-carboxamide
SMILESO=C(NCC1CNCCO1)c1cncnc1
InChIInChI=1S/C10H14N4O2/c15-10(8-3-12-7-13-4-8)14-6-9-5-11-1-2-16-9/h3-4,7,9,11H,1-2,5-6H2,(H,14,15)
InChIKeyIDCSKAVQSGYHBK-UHFFFAOYSA-N
XLogP-0.81
TPSA76.14 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.25
LogP ≤ 5-0.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(morpholin-2-ylmethyl)pyridazine-4-carboxamide
CID 104671734
3-fluoro-4-methyl-N-(morpholin-2-ylmethyl)benzamide
CID 43603078
N-[[(2S)-morpholin-2-yl]methyl]-4-[4-(2H-tetrazol-5-yl)phenyl]benzamide
CID 126427910
2,6-dichloro-N-(morpholin-2-ylmethyl)benzamide
CID 113287074
3-chloro-N-(morpholin-2-ylmethyl)-5-nitrobenzamide
CID 115323738
4-methyl-N-(morpholin-2-ylmethyl)-1,3-thiazole-5-carboxamide
CID 115323889
4-amino-1-methyl-N-(morpholin-2-ylmethyl)pyrazole-3-carboxamide
CID 122445315
1,5-dimethyl-N-[[(2R)-morpholin-2-yl]methyl]pyrazole-3-carboxamide
CID 143160987
4-chloro-2,5-difluoro-N-(morpholin-2-ylmethyl)benzamide
CID 82772508
N-(morpholin-2-ylmethyl)-3-pyridin-3-ylpropanamide
CID 115323825
5-chloro-2-hydroxy-N-(morpholin-2-ylmethyl)benzamide
CID 115323836
4-chloro-2-methyl-N-(morpholin-2-ylmethyl)benzamide
CID 114028076

Frequently Asked Questions

What is the IUPAC name of N-(morpholin-2-ylmethyl)pyrimidine-5-carboxamide?
The IUPAC name of N-(morpholin-2-ylmethyl)pyrimidine-5-carboxamide (CID 102922356) is N-(morpholin-2-ylmethyl)pyrimidine-5-carboxamide.
What is the SMILES notation for N-(morpholin-2-ylmethyl)pyrimidine-5-carboxamide?
The canonical SMILES for N-(morpholin-2-ylmethyl)pyrimidine-5-carboxamide is O=C(NCC1CNCCO1)c1cncnc1.
What is the InChIKey of N-(morpholin-2-ylmethyl)pyrimidine-5-carboxamide?
The InChIKey is IDCSKAVQSGYHBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N4O2/c15-10(8-3-12-7-13-4-8)14-6-9-5-11-1-2-16-9/h3-4,7,9,11H,1-2,5-6H2,(H,14,15).
What are the key properties of N-(morpholin-2-ylmethyl)pyrimidine-5-carboxamide?
N-(morpholin-2-ylmethyl)pyrimidine-5-carboxamide has a molecular weight of 222.25 g/mol, XLogP of -0.81, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(morpholin-2-ylmethyl)pyrimidine-5-carboxamide is sourced from PubChem (CID 102922356), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).