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

C16H26N4O2 — CID 109343942

IUPAC6-(dipropylamino)-N-(oxolan-2-ylmethyl)pyrimidine-4-carboxamide
SMILESCCCN(CCC)c1cc(C(=O)NCC2CCCO2)ncn1
InChIInChI=1S/C16H26N4O2/c1-3-7-20(8-4-2)15-10-14(18-12-19-15)16(21)17-11-13-6-5-9-22-13/h10,12-13H,3-9,11H2,1-2H3,(H,17,21)
InChIKeyCFMUFTWVQQQKIZ-UHFFFAOYSA-N
MW306.41 g/mol
LogP2.01
Rot. Bonds8

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

6-(dipropylamino)-N-(oxolan-2-ylmethyl)pyrimidine-4-carboxamide (PubChem CID 109343942) has the molecular formula C16H26N4O2 and a molecular weight of 306.41 g/mol. Its IUPAC name is 6-(dipropylamino)-N-(oxolan-2-ylmethyl)pyrimidine-4-carboxamide.

Molecular Properties

Compound Name6-(dipropylamino)-N-(oxolan-2-ylmethyl)pyrimidine-4-carboxamide
PubChem CID109343942
Molecular FormulaC16H26N4O2
Molecular Weight306.41 g/mol
Exact Mass306.21
IUPAC Name6-(dipropylamino)-N-(oxolan-2-ylmethyl)pyrimidine-4-carboxamide
SMILESCCCN(CCC)c1cc(C(=O)NCC2CCCO2)ncn1
InChIInChI=1S/C16H26N4O2/c1-3-7-20(8-4-2)15-10-14(18-12-19-15)16(21)17-11-13-6-5-9-22-13/h10,12-13H,3-9,11H2,1-2H3,(H,17,21)
InChIKeyCFMUFTWVQQQKIZ-UHFFFAOYSA-N
XLogP2.01
TPSA67.35 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.41
LogP ≤ 52.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

6-(dipropylamino)-N-(oxolan-2-ylmethyl)pyridine-3-carboxamide
CID 109153658
2-N-(oxolan-2-ylmethyl)-4-N,4-N-dipropylpyridine-2,4-dicarboxamide
CID 109083306
5-(dipropylamino)-N-(oxolan-2-ylmethyl)pyridine-3-carboxamide
CID 109228799
6-[4-(diethylamino)anilino]-N-(oxolan-2-ylmethyl)pyrimidine-4-carboxamide
CID 109344009
4-N,4-N-diethyl-2-N-(oxolan-2-ylmethyl)pyridine-2,4-dicarboxamide
CID 109083295
4-methyl-N-(oxolan-2-ylmethyl)pyridine-2-carboxamide
CID 110849466
5-fluoro-4-methyl-N-(oxolan-2-ylmethyl)pyridine-2-carboxamide
CID 146080052
4-(ethylamino)-N-(oxolan-2-ylmethyl)pyridine-2-carboxamide
CID 62173174
6-(2-chloro-4,6-dimethylanilino)-N-(oxolan-2-ylmethyl)pyrimidine-4-carboxamide
CID 109343981
6-(oxolan-2-ylmethylamino)-N-prop-2-enylpyrimidine-4-carboxamide
CID 109339622
6-(4-chloro-2-methoxy-5-methylanilino)-N-(oxolan-2-ylmethyl)pyrimidine-4-carboxamide
CID 109344039
6-(2-methoxyanilino)-N-(oxolan-2-ylmethyl)pyrimidine-4-carboxamide
CID 109343986

Frequently Asked Questions

What is the IUPAC name of 6-(dipropylamino)-N-(oxolan-2-ylmethyl)pyrimidine-4-carboxamide?
The IUPAC name of 6-(dipropylamino)-N-(oxolan-2-ylmethyl)pyrimidine-4-carboxamide (CID 109343942) is 6-(dipropylamino)-N-(oxolan-2-ylmethyl)pyrimidine-4-carboxamide.
What is the SMILES notation for 6-(dipropylamino)-N-(oxolan-2-ylmethyl)pyrimidine-4-carboxamide?
The canonical SMILES for 6-(dipropylamino)-N-(oxolan-2-ylmethyl)pyrimidine-4-carboxamide is CCCN(CCC)c1cc(C(=O)NCC2CCCO2)ncn1.
What is the InChIKey of 6-(dipropylamino)-N-(oxolan-2-ylmethyl)pyrimidine-4-carboxamide?
The InChIKey is CFMUFTWVQQQKIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N4O2/c1-3-7-20(8-4-2)15-10-14(18-12-19-15)16(21)17-11-13-6-5-9-22-13/h10,12-13H,3-9,11H2,1-2H3,(H,17,21).
What are the key properties of 6-(dipropylamino)-N-(oxolan-2-ylmethyl)pyrimidine-4-carboxamide?
6-(dipropylamino)-N-(oxolan-2-ylmethyl)pyrimidine-4-carboxamide has a molecular weight of 306.41 g/mol, XLogP of 2.01, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(dipropylamino)-N-(oxolan-2-ylmethyl)pyrimidine-4-carboxamide is sourced from PubChem (CID 109343942), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).