2-amino-6-(furan-2-yl)-N-[(3-propyl-2,4-dihydroimidazol-2-yl)methyl]pyrimidine-4-carboxamide

C16H20N6O2 — CID 91064332

IUPAC2-amino-6-(furan-2-yl)-N-[(3-propyl-2,4-dihydroimidazol-2-yl)methyl]pyrimidine-4-carboxamide
SMILESCCCN1CC=NC1CNC(=O)c1cc(-c2ccco2)nc(N)n1
InChIInChI=1S/C16H20N6O2/c1-2-6-22-7-5-18-14(22)10-19-15(23)12-9-11(20-16(17)21-12)13-4-3-8-24-13/h3-5,8-9,14H,2,6-7,10H2,1H3,(H,19,23)(H2,17,20,21)
InChIKeyPGPOVOGNWZSVLX-UHFFFAOYSA-N
MW328.38 g/mol
LogP1.17
Rot. Bonds6

About 2-amino-6-(furan-2-yl)-N-[(3-propyl-2,4-dihydroimidazol-2-yl)methyl]pyrimidine-4-carboxamide

2-amino-6-(furan-2-yl)-N-[(3-propyl-2,4-dihydroimidazol-2-yl)methyl]pyrimidine-4-carboxamide (PubChem CID 91064332) has the molecular formula C16H20N6O2 and a molecular weight of 328.38 g/mol. Its IUPAC name is 2-amino-6-(furan-2-yl)-N-[(3-propyl-2,4-dihydroimidazol-2-yl)methyl]pyrimidine-4-carboxamide.

Molecular Properties

Compound Name2-amino-6-(furan-2-yl)-N-[(3-propyl-2,4-dihydroimidazol-2-yl)methyl]pyrimidine-4-carboxamide
PubChem CID91064332
Molecular FormulaC16H20N6O2
Molecular Weight328.38 g/mol
Exact Mass328.16
IUPAC Name2-amino-6-(furan-2-yl)-N-[(3-propyl-2,4-dihydroimidazol-2-yl)methyl]pyrimidine-4-carboxamide
SMILESCCCN1CC=NC1CNC(=O)c1cc(-c2ccco2)nc(N)n1
InChIInChI=1S/C16H20N6O2/c1-2-6-22-7-5-18-14(22)10-19-15(23)12-9-11(20-16(17)21-12)13-4-3-8-24-13/h3-5,8-9,14H,2,6-7,10H2,1H3,(H,19,23)(H2,17,20,21)
InChIKeyPGPOVOGNWZSVLX-UHFFFAOYSA-N
XLogP1.17
TPSA109.64 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.38
LogP ≤ 51.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Related Compounds

2-amino-6-(furan-2-yl)-N-(2-methoxyethyl)pyrimidine-4-carboxamide
CID 11737091
[2-amino-6-(furan-2-yl)pyrimidin-4-yl]-piperidin-1-ylmethanone
CID 11173320
[6-[[[2-amino-6-(furan-2-yl)pyrimidine-4-carbonyl]amino]methyl]-2-pyridinyl]methyl N-hexylcarbamate
CID 11385446
2-amino-6-(furan-2-yl)-N-(3-methyl-2-pyridinyl)pyrimidine-4-carboxamide
CID 11197188
2-amino-N-[(2,3-dimethyl-1H-indol-5-yl)methyl]-6-(furan-2-yl)pyrimidine-4-carboxamide
CID 11473907
2-amino-6-(furan-2-yl)-N-[2-(1H-indol-3-yl)ethyl]pyrimidine-4-carboxamide
CID 11416733
2-amino-N-benzyl-6-(furan-2-yl)-N-methylpyrimidine-4-carboxamide
CID 59022943
2-amino-6-(furan-2-yl)-N-[[(4Z)-5-methylidene-4-prop-2-enylidene-2-pyridinyl]methyl]pyrimidine-4-carboxamide
CID 143092124
2-amino-N-hexyl-6-(5-methylfuran-2-yl)pyrimidine-4-carboxamide
CID 59022894
2-amino-6-(5-methylfuran-2-yl)-N-(oxolan-2-ylmethyl)pyrimidine-4-carboxamide
CID 11403877
7-ethyl-2-(furan-2-yl)-N-(furan-2-ylmethyl)pyrazolo[1,5-a]pyrimidine-5-carboxamide
CID 53040644
2-amino-6-(5-methylfuran-2-yl)-N-[(1-methylpyrazol-3-yl)methyl]pyrimidine-4-carboxamide
CID 59022880

Frequently Asked Questions

What is the IUPAC name of 2-amino-6-(furan-2-yl)-N-[(3-propyl-2,4-dihydroimidazol-2-yl)methyl]pyrimidine-4-carboxamide?
The IUPAC name of 2-amino-6-(furan-2-yl)-N-[(3-propyl-2,4-dihydroimidazol-2-yl)methyl]pyrimidine-4-carboxamide (CID 91064332) is 2-amino-6-(furan-2-yl)-N-[(3-propyl-2,4-dihydroimidazol-2-yl)methyl]pyrimidine-4-carboxamide.
What is the SMILES notation for 2-amino-6-(furan-2-yl)-N-[(3-propyl-2,4-dihydroimidazol-2-yl)methyl]pyrimidine-4-carboxamide?
The canonical SMILES for 2-amino-6-(furan-2-yl)-N-[(3-propyl-2,4-dihydroimidazol-2-yl)methyl]pyrimidine-4-carboxamide is CCCN1CC=NC1CNC(=O)c1cc(-c2ccco2)nc(N)n1.
What is the InChIKey of 2-amino-6-(furan-2-yl)-N-[(3-propyl-2,4-dihydroimidazol-2-yl)methyl]pyrimidine-4-carboxamide?
The InChIKey is PGPOVOGNWZSVLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N6O2/c1-2-6-22-7-5-18-14(22)10-19-15(23)12-9-11(20-16(17)21-12)13-4-3-8-24-13/h3-5,8-9,14H,2,6-7,10H2,1H3,(H,19,23)(H2,17,20,21).
What are the key properties of 2-amino-6-(furan-2-yl)-N-[(3-propyl-2,4-dihydroimidazol-2-yl)methyl]pyrimidine-4-carboxamide?
2-amino-6-(furan-2-yl)-N-[(3-propyl-2,4-dihydroimidazol-2-yl)methyl]pyrimidine-4-carboxamide has a molecular weight of 328.38 g/mol, XLogP of 1.17, 6 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-6-(furan-2-yl)-N-[(3-propyl-2,4-dihydroimidazol-2-yl)methyl]pyrimidine-4-carboxamide is sourced from PubChem (CID 91064332), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).