2-amino-5-ethyl-6-(5-methylfuran-2-yl)-N-[(3-methyl-2-pyridinyl)methyl]pyrimidine-4-carboxamide

C19H21N5O2 — CID 44520974

IUPAC2-amino-5-ethyl-6-(5-methylfuran-2-yl)-N-[(3-methyl-2-pyridinyl)methyl]pyrimidine-4-carboxamide
SMILESCCc1c(C(=O)NCc2ncccc2C)nc(N)nc1-c1ccc(C)o1
InChIInChI=1S/C19H21N5O2/c1-4-13-16(15-8-7-12(3)26-15)23-19(20)24-17(13)18(25)22-10-14-11(2)6-5-9-21-14/h5-9H,4,10H2,1-3H3,(H,22,25)(H2,20,23,24)
InChIKeyYOVOVQDSVQMVGL-UHFFFAOYSA-N
MW351.41 g/mol
LogP2.82
Rot. Bonds5

About 2-amino-5-ethyl-6-(5-methylfuran-2-yl)-N-[(3-methyl-2-pyridinyl)methyl]pyrimidine-4-carboxamide

2-amino-5-ethyl-6-(5-methylfuran-2-yl)-N-[(3-methyl-2-pyridinyl)methyl]pyrimidine-4-carboxamide (PubChem CID 44520974) has the molecular formula C19H21N5O2 and a molecular weight of 351.41 g/mol. Its IUPAC name is 2-amino-5-ethyl-6-(5-methylfuran-2-yl)-N-[(3-methyl-2-pyridinyl)methyl]pyrimidine-4-carboxamide.

Molecular Properties

Compound Name2-amino-5-ethyl-6-(5-methylfuran-2-yl)-N-[(3-methyl-2-pyridinyl)methyl]pyrimidine-4-carboxamide
PubChem CID44520974
Molecular FormulaC19H21N5O2
Molecular Weight351.41 g/mol
Exact Mass351.17
IUPAC Name2-amino-5-ethyl-6-(5-methylfuran-2-yl)-N-[(3-methyl-2-pyridinyl)methyl]pyrimidine-4-carboxamide
SMILESCCc1c(C(=O)NCc2ncccc2C)nc(N)nc1-c1ccc(C)o1
InChIInChI=1S/C19H21N5O2/c1-4-13-16(15-8-7-12(3)26-15)23-19(20)24-17(13)18(25)22-10-14-11(2)6-5-9-21-14/h5-9H,4,10H2,1-3H3,(H,22,25)(H2,20,23,24)
InChIKeyYOVOVQDSVQMVGL-UHFFFAOYSA-N
XLogP2.82
TPSA106.93 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.41
LogP ≤ 52.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 2-amino-5-ethyl-6-(5-methylfuran-2-yl)-N-[(3-methyl-2-pyridinyl)methyl]pyrimidine-4-carboxamide with MolForge

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Related Compounds

Las-38096
CID 11716665
Pyrimidine-4-carboxamide, 118
CID 44520982
Dipyridodiazepinone deriv. 39
CID 463559
Pyrimidine-4-carboxamide, 26
CID 11220580
Pyrimidine-4-carboxamide, 122
CID 11232232
Pyrimidine-4-carboxamide, 109
CID 11324754
Pyrimidine-4-carboxamide, 117
CID 11381773
Pyrimidine-4-carboxamide, 25
CID 11426423
1-{(3s)-1-[4-(1-Benzofuran-2-Yl)pyrimidin-2-Yl]piperidin-3-Yl}-3-Ethyl-1,3-Dihydro-2h-Benzimidazol-2-One
CID 25198728
Pyrimidine-4-carboxamide, 27
CID 44520941
4-Pyrimidinecarboxamide,2-amino-6-(3-methoxyphenyl)-n-(2-pyridinylmethyl)-
CID 44520951
4-Pyrimidinecarboxamide,2-amino-6-(3-methoxyphenyl)-n-[(3-methyl-2-pyridinyl)methyl]-
CID 44520964

Frequently Asked Questions

What is the IUPAC name of 2-amino-5-ethyl-6-(5-methylfuran-2-yl)-N-[(3-methyl-2-pyridinyl)methyl]pyrimidine-4-carboxamide?
The IUPAC name of 2-amino-5-ethyl-6-(5-methylfuran-2-yl)-N-[(3-methyl-2-pyridinyl)methyl]pyrimidine-4-carboxamide (CID 44520974) is 2-amino-5-ethyl-6-(5-methylfuran-2-yl)-N-[(3-methyl-2-pyridinyl)methyl]pyrimidine-4-carboxamide.
What is the SMILES notation for 2-amino-5-ethyl-6-(5-methylfuran-2-yl)-N-[(3-methyl-2-pyridinyl)methyl]pyrimidine-4-carboxamide?
The canonical SMILES for 2-amino-5-ethyl-6-(5-methylfuran-2-yl)-N-[(3-methyl-2-pyridinyl)methyl]pyrimidine-4-carboxamide is CCc1c(C(=O)NCc2ncccc2C)nc(N)nc1-c1ccc(C)o1.
What is the InChIKey of 2-amino-5-ethyl-6-(5-methylfuran-2-yl)-N-[(3-methyl-2-pyridinyl)methyl]pyrimidine-4-carboxamide?
The InChIKey is YOVOVQDSVQMVGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N5O2/c1-4-13-16(15-8-7-12(3)26-15)23-19(20)24-17(13)18(25)22-10-14-11(2)6-5-9-21-14/h5-9H,4,10H2,1-3H3,(H,22,25)(H2,20,23,24).
What are the key properties of 2-amino-5-ethyl-6-(5-methylfuran-2-yl)-N-[(3-methyl-2-pyridinyl)methyl]pyrimidine-4-carboxamide?
2-amino-5-ethyl-6-(5-methylfuran-2-yl)-N-[(3-methyl-2-pyridinyl)methyl]pyrimidine-4-carboxamide has a molecular weight of 351.41 g/mol, XLogP of 2.82, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-5-ethyl-6-(5-methylfuran-2-yl)-N-[(3-methyl-2-pyridinyl)methyl]pyrimidine-4-carboxamide is sourced from PubChem (CID 44520974), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).