N-cyclopentyl-6-(furan-2-ylmethylamino)pyrimidine-4-carboxamide

C15H18N4O2 — CID 109341395

IUPACN-cyclopentyl-6-(furan-2-ylmethylamino)pyrimidine-4-carboxamide
SMILESO=C(NC1CCCC1)c1cc(NCc2ccco2)ncn1
InChIInChI=1S/C15H18N4O2/c20-15(19-11-4-1-2-5-11)13-8-14(18-10-17-13)16-9-12-6-3-7-21-12/h3,6-8,10-11H,1-2,4-5,9H2,(H,19,20)(H,16,17,18)
InChIKeyAFJOIYDUTWNFPE-UHFFFAOYSA-N
MW286.33 g/mol
LogP2.35
Rot. Bonds5

About N-cyclopentyl-6-(furan-2-ylmethylamino)pyrimidine-4-carboxamide

N-cyclopentyl-6-(furan-2-ylmethylamino)pyrimidine-4-carboxamide (PubChem CID 109341395) has the molecular formula C15H18N4O2 and a molecular weight of 286.33 g/mol. Its IUPAC name is N-cyclopentyl-6-(furan-2-ylmethylamino)pyrimidine-4-carboxamide.

Molecular Properties

Compound NameN-cyclopentyl-6-(furan-2-ylmethylamino)pyrimidine-4-carboxamide
PubChem CID109341395
Molecular FormulaC15H18N4O2
Molecular Weight286.33 g/mol
Exact Mass286.14
IUPAC NameN-cyclopentyl-6-(furan-2-ylmethylamino)pyrimidine-4-carboxamide
SMILESO=C(NC1CCCC1)c1cc(NCc2ccco2)ncn1
InChIInChI=1S/C15H18N4O2/c20-15(19-11-4-1-2-5-11)13-8-14(18-10-17-13)16-9-12-6-3-7-21-12/h3,6-8,10-11H,1-2,4-5,9H2,(H,19,20)(H,16,17,18)
InChIKeyAFJOIYDUTWNFPE-UHFFFAOYSA-N
XLogP2.35
TPSA80.05 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.33
LogP ≤ 52.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-cyclopentyl-5-(furan-2-ylmethylamino)pyrazine-2-carboxamide
CID 109273898
6-(furan-2-ylmethylamino)-N-phenylpyrimidine-4-carboxamide
CID 109346189
N-cyclopropyl-4-(furan-2-ylmethylamino)pyridine-2-carboxamide
CID 109201702
N-cyclohexyl-5-(furan-2-ylmethylamino)pyridine-2-carboxamide
CID 109182916
2-N-cyclopentyl-4-N-(furan-2-ylmethyl)pyridine-2,4-dicarboxamide
CID 109080870
N-(2,6-difluorophenyl)-6-(furan-2-ylmethylamino)pyrimidine-4-carboxamide
CID 109346291
N-(furan-2-ylmethyl)-6-(oxolan-2-ylmethylamino)pyrimidine-4-carboxamide
CID 109343710
N-cyclohexyl-6-[(3-methylphenyl)methylamino]pyrimidine-4-carboxamide
CID 109341985
N-[(4-chlorophenyl)methyl]-6-(furan-2-ylmethylamino)pyrimidine-4-carboxamide
CID 109346134
N-cyclopropyl-2-(furan-2-ylmethylamino)pyrimidine-4-carboxamide
CID 109295735
6-(furan-2-ylmethylamino)-N-[4-(trifluoromethyl)phenyl]pyrimidine-4-carboxamide
CID 109346240
N-[4-chloro-3-(trifluoromethyl)phenyl]-6-(furan-2-ylmethylamino)pyrimidine-4-carboxamide
CID 109346273

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-6-(furan-2-ylmethylamino)pyrimidine-4-carboxamide?
The IUPAC name of N-cyclopentyl-6-(furan-2-ylmethylamino)pyrimidine-4-carboxamide (CID 109341395) is N-cyclopentyl-6-(furan-2-ylmethylamino)pyrimidine-4-carboxamide.
What is the SMILES notation for N-cyclopentyl-6-(furan-2-ylmethylamino)pyrimidine-4-carboxamide?
The canonical SMILES for N-cyclopentyl-6-(furan-2-ylmethylamino)pyrimidine-4-carboxamide is O=C(NC1CCCC1)c1cc(NCc2ccco2)ncn1.
What is the InChIKey of N-cyclopentyl-6-(furan-2-ylmethylamino)pyrimidine-4-carboxamide?
The InChIKey is AFJOIYDUTWNFPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N4O2/c20-15(19-11-4-1-2-5-11)13-8-14(18-10-17-13)16-9-12-6-3-7-21-12/h3,6-8,10-11H,1-2,4-5,9H2,(H,19,20)(H,16,17,18).
What are the key properties of N-cyclopentyl-6-(furan-2-ylmethylamino)pyrimidine-4-carboxamide?
N-cyclopentyl-6-(furan-2-ylmethylamino)pyrimidine-4-carboxamide has a molecular weight of 286.33 g/mol, XLogP of 2.35, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-6-(furan-2-ylmethylamino)pyrimidine-4-carboxamide is sourced from PubChem (CID 109341395), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).