6-(dipropylamino)-N-(furan-2-ylmethyl)pyrimidine-4-carboxamide

C16H22N4O2 — CID 109346353

IUPAC6-(dipropylamino)-N-(furan-2-ylmethyl)pyrimidine-4-carboxamide
SMILESCCCN(CCC)c1cc(C(=O)NCc2ccco2)ncn1
InChIInChI=1S/C16H22N4O2/c1-3-7-20(8-4-2)15-10-14(18-12-19-15)16(21)17-11-13-6-5-9-22-13/h5-6,9-10,12H,3-4,7-8,11H2,1-2H3,(H,17,21)
InChIKeyLXCNAYKMBSAJBH-UHFFFAOYSA-N
MW302.38 g/mol
LogP2.63
Rot. Bonds8

About 6-(dipropylamino)-N-(furan-2-ylmethyl)pyrimidine-4-carboxamide

6-(dipropylamino)-N-(furan-2-ylmethyl)pyrimidine-4-carboxamide (PubChem CID 109346353) has the molecular formula C16H22N4O2 and a molecular weight of 302.38 g/mol. Its IUPAC name is 6-(dipropylamino)-N-(furan-2-ylmethyl)pyrimidine-4-carboxamide.

Molecular Properties

Compound Name6-(dipropylamino)-N-(furan-2-ylmethyl)pyrimidine-4-carboxamide
PubChem CID109346353
Molecular FormulaC16H22N4O2
Molecular Weight302.38 g/mol
Exact Mass302.17
IUPAC Name6-(dipropylamino)-N-(furan-2-ylmethyl)pyrimidine-4-carboxamide
SMILESCCCN(CCC)c1cc(C(=O)NCc2ccco2)ncn1
InChIInChI=1S/C16H22N4O2/c1-3-7-20(8-4-2)15-10-14(18-12-19-15)16(21)17-11-13-6-5-9-22-13/h5-6,9-10,12H,3-4,7-8,11H2,1-2H3,(H,17,21)
InChIKeyLXCNAYKMBSAJBH-UHFFFAOYSA-N
XLogP2.63
TPSA71.26 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.38
LogP ≤ 52.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

6-(N-ethylanilino)-N-(furan-2-ylmethyl)pyrimidine-4-carboxamide
CID 109346373
5-(dipropylamino)-N-(furan-2-ylmethyl)pyridine-3-carboxamide
CID 109231347
N-(furan-2-ylmethyl)-5-propyl-1,2-oxazole-3-carboxamide
CID 5307986
N-(furan-2-ylmethyl)-6-(3-methylanilino)pyrimidine-4-carboxamide
CID 109346360
6-(4-tert-butylanilino)-N-(furan-2-ylmethyl)pyrimidine-4-carboxamide
CID 109346381
4-[2-(dimethylamino)ethylamino]-N-(furan-2-ylmethyl)pyridine-2-carboxamide
CID 109207271
3-N-(furan-2-ylmethyl)-5-N,5-N-dipropylpyridine-3,5-dicarboxamide
CID 109104880
6-(3-chloro-2-methylanilino)-N-(furan-2-ylmethyl)pyrimidine-4-carboxamide
CID 109346387
6-(ethylamino)-N-(furan-2-ylmethyl)pyridazine-3-carboxamide
CID 62172875
N-(furan-2-ylmethyl)-6-(4-propan-2-yloxyanilino)pyrimidine-4-carboxamide
CID 109346404
6-(2,3-dichloroanilino)-N-(furan-2-ylmethyl)pyrimidine-4-carboxamide
CID 109346451
6-amino-N-(furan-2-ylmethyl)pyridazine-3-carboxamide
CID 62156387

Frequently Asked Questions

What is the IUPAC name of 6-(dipropylamino)-N-(furan-2-ylmethyl)pyrimidine-4-carboxamide?
The IUPAC name of 6-(dipropylamino)-N-(furan-2-ylmethyl)pyrimidine-4-carboxamide (CID 109346353) is 6-(dipropylamino)-N-(furan-2-ylmethyl)pyrimidine-4-carboxamide.
What is the SMILES notation for 6-(dipropylamino)-N-(furan-2-ylmethyl)pyrimidine-4-carboxamide?
The canonical SMILES for 6-(dipropylamino)-N-(furan-2-ylmethyl)pyrimidine-4-carboxamide is CCCN(CCC)c1cc(C(=O)NCc2ccco2)ncn1.
What is the InChIKey of 6-(dipropylamino)-N-(furan-2-ylmethyl)pyrimidine-4-carboxamide?
The InChIKey is LXCNAYKMBSAJBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N4O2/c1-3-7-20(8-4-2)15-10-14(18-12-19-15)16(21)17-11-13-6-5-9-22-13/h5-6,9-10,12H,3-4,7-8,11H2,1-2H3,(H,17,21).
What are the key properties of 6-(dipropylamino)-N-(furan-2-ylmethyl)pyrimidine-4-carboxamide?
6-(dipropylamino)-N-(furan-2-ylmethyl)pyrimidine-4-carboxamide has a molecular weight of 302.38 g/mol, XLogP of 2.63, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(dipropylamino)-N-(furan-2-ylmethyl)pyrimidine-4-carboxamide is sourced from PubChem (CID 109346353), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).