4-ethyl-2-morpholin-4-yl-N-[[(3R)-1-propan-2-ylpiperidin-3-yl]methyl]pyrimidine-5-carboxamide

C20H33N5O2 — CID 92588463

IUPAC4-ethyl-2-morpholin-4-yl-N-[[(3R)-1-propan-2-ylpiperidin-3-yl]methyl]pyrimidine-5-carboxamide
SMILESCCc1nc(N2CCOCC2)ncc1C(=O)NC[C@H]1CCCN(C(C)C)C1
InChIInChI=1S/C20H33N5O2/c1-4-18-17(13-22-20(23-18)24-8-10-27-11-9-24)19(26)21-12-16-6-5-7-25(14-16)15(2)3/h13,15-16H,4-12,14H2,1-3H3,(H,21,26)/t16-/m1/s1
InChIKeyNLYAEDSIPNDBLG-MRXNPFEDSA-N
MW375.52 g/mol
LogP1.73
Rot. Bonds6

About 4-ethyl-2-morpholin-4-yl-N-[[(3R)-1-propan-2-ylpiperidin-3-yl]methyl]pyrimidine-5-carboxamide

4-ethyl-2-morpholin-4-yl-N-[[(3R)-1-propan-2-ylpiperidin-3-yl]methyl]pyrimidine-5-carboxamide (PubChem CID 92588463) has the molecular formula C20H33N5O2 and a molecular weight of 375.52 g/mol. Its IUPAC name is 4-ethyl-2-morpholin-4-yl-N-[[(3R)-1-propan-2-ylpiperidin-3-yl]methyl]pyrimidine-5-carboxamide.

Molecular Properties

Compound Name4-ethyl-2-morpholin-4-yl-N-[[(3R)-1-propan-2-ylpiperidin-3-yl]methyl]pyrimidine-5-carboxamide
PubChem CID92588463
Molecular FormulaC20H33N5O2
Molecular Weight375.52 g/mol
Exact Mass375.26
IUPAC Name4-ethyl-2-morpholin-4-yl-N-[[(3R)-1-propan-2-ylpiperidin-3-yl]methyl]pyrimidine-5-carboxamide
SMILESCCc1nc(N2CCOCC2)ncc1C(=O)NC[C@H]1CCCN(C(C)C)C1
InChIInChI=1S/C20H33N5O2/c1-4-18-17(13-22-20(23-18)24-8-10-27-11-9-24)19(26)21-12-16-6-5-7-25(14-16)15(2)3/h13,15-16H,4-12,14H2,1-3H3,(H,21,26)/t16-/m1/s1
InChIKeyNLYAEDSIPNDBLG-MRXNPFEDSA-N
XLogP1.73
TPSA70.59 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.52
LogP ≤ 51.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 4-ethyl-2-morpholin-4-yl-N-[[(3R)-1-propan-2-ylpiperidin-3-yl]methyl]pyrimidine-5-carboxamide with MolForge

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Launch Full Analysis

Related Compounds

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CID 46964047
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CID 95204324
N-[[(3R)-1-propan-2-ylpiperidin-3-yl]methyl]pyrimidine-5-carboxamide
CID 125137746
2-ethoxy-N-[[(3R)-1-propan-2-ylpiperidin-3-yl]methyl]pyridine-3-carboxamide
CID 94799467
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2-chloro-5-methylsulfanyl-N-[[(3R)-1-propan-2-ylpiperidin-3-yl]methyl]benzamide
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5-fluoro-2-iodo-N-[(1-propan-2-ylpiperidin-3-yl)methyl]benzamide
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N-[(1-propan-2-ylpiperidin-3-yl)methyl]-2-sulfanylidene-1H-pyridine-3-carboxamide
CID 60614096
1-(4-fluorophenyl)-5-methyl-N-[[(3S)-1-propan-2-ylpiperidin-3-yl]methyl]pyrazole-4-carboxamide
CID 52510251
1-[2-(2-ethyl-1,3-thiazol-4-yl)ethyl]-3-[(1-propan-2-ylpiperidin-3-yl)methyl]urea
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Frequently Asked Questions

What is the IUPAC name of 4-ethyl-2-morpholin-4-yl-N-[[(3R)-1-propan-2-ylpiperidin-3-yl]methyl]pyrimidine-5-carboxamide?
The IUPAC name of 4-ethyl-2-morpholin-4-yl-N-[[(3R)-1-propan-2-ylpiperidin-3-yl]methyl]pyrimidine-5-carboxamide (CID 92588463) is 4-ethyl-2-morpholin-4-yl-N-[[(3R)-1-propan-2-ylpiperidin-3-yl]methyl]pyrimidine-5-carboxamide.
What is the SMILES notation for 4-ethyl-2-morpholin-4-yl-N-[[(3R)-1-propan-2-ylpiperidin-3-yl]methyl]pyrimidine-5-carboxamide?
The canonical SMILES for 4-ethyl-2-morpholin-4-yl-N-[[(3R)-1-propan-2-ylpiperidin-3-yl]methyl]pyrimidine-5-carboxamide is CCc1nc(N2CCOCC2)ncc1C(=O)NC[C@H]1CCCN(C(C)C)C1.
What is the InChIKey of 4-ethyl-2-morpholin-4-yl-N-[[(3R)-1-propan-2-ylpiperidin-3-yl]methyl]pyrimidine-5-carboxamide?
The InChIKey is NLYAEDSIPNDBLG-MRXNPFEDSA-N. The full InChI is InChI=1S/C20H33N5O2/c1-4-18-17(13-22-20(23-18)24-8-10-27-11-9-24)19(26)21-12-16-6-5-7-25(14-16)15(2)3/h13,15-16H,4-12,14H2,1-3H3,(H,21,26)/t16-/m1/s1.
What are the key properties of 4-ethyl-2-morpholin-4-yl-N-[[(3R)-1-propan-2-ylpiperidin-3-yl]methyl]pyrimidine-5-carboxamide?
4-ethyl-2-morpholin-4-yl-N-[[(3R)-1-propan-2-ylpiperidin-3-yl]methyl]pyrimidine-5-carboxamide has a molecular weight of 375.52 g/mol, XLogP of 1.73, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-2-morpholin-4-yl-N-[[(3R)-1-propan-2-ylpiperidin-3-yl]methyl]pyrimidine-5-carboxamide is sourced from PubChem (CID 92588463), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).