4-(dimethoxymethyl)-N-propylpyrimidin-2-amine

C10H17N3O2 — CID 146441293

IUPAC4-(dimethoxymethyl)-N-propylpyrimidin-2-amine
SMILESCCCNc1nccc(C(OC)OC)n1
InChIInChI=1S/C10H17N3O2/c1-4-6-11-10-12-7-5-8(13-10)9(14-2)15-3/h5,7,9H,4,6H2,1-3H3,(H,11,12,13)
InChIKeyOVZIDQHHOIVFPW-UHFFFAOYSA-N
MW211.26 g/mol
LogP1.59
Rot. Bonds6

About 4-(dimethoxymethyl)-N-propylpyrimidin-2-amine

4-(dimethoxymethyl)-N-propylpyrimidin-2-amine (PubChem CID 146441293) has the molecular formula C10H17N3O2 and a molecular weight of 211.26 g/mol. Its IUPAC name is 4-(dimethoxymethyl)-N-propylpyrimidin-2-amine.

Molecular Properties

Compound Name4-(dimethoxymethyl)-N-propylpyrimidin-2-amine
PubChem CID146441293
Molecular FormulaC10H17N3O2
Molecular Weight211.26 g/mol
Exact Mass211.13
IUPAC Name4-(dimethoxymethyl)-N-propylpyrimidin-2-amine
SMILESCCCNc1nccc(C(OC)OC)n1
InChIInChI=1S/C10H17N3O2/c1-4-6-11-10-12-7-5-8(13-10)9(14-2)15-3/h5,7,9H,4,6H2,1-3H3,(H,11,12,13)
InChIKeyOVZIDQHHOIVFPW-UHFFFAOYSA-N
XLogP1.59
TPSA56.27 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.26
LogP ≤ 51.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

4-propan-2-yloxy-N-propylpyrimidin-2-amine
CID 80860726
4-N-(2-methoxypropyl)-4-N-methyl-2-N-propylpyrimidine-2,4-diamine
CID 112754759
diethyl 2-[(R)-[[4-(dimethoxymethyl)pyrimidin-2-yl]amino]-(4-methoxyphenyl)methyl]propanedioate
CID 177389258
4-propan-2-ylsulfanyl-N-propylpyrimidin-2-amine
CID 80886291
4-(4-methylphenoxy)-N-propylpyrimidin-2-amine
CID 80862544
4-(4-chlorophenyl)sulfanyl-N-propylpyrimidin-2-amine
CID 80888094
4-pentan-2-yloxy-N-propylpyrimidin-2-amine
CID 102989423
4-(3-methylbutylsulfanyl)-N-propylpyrimidin-2-amine
CID 107766037
2-[2-(propylamino)pyrimidin-4-yl]oxyethanol
CID 80860272
4-[(4-methoxyphenyl)methoxy]-N-propylpyrimidin-2-amine
CID 80866869
4-N-(5-methoxypentyl)-2-N-propylpyrimidine-2,4-diamine
CID 114131267
4-naphthalen-2-ylsulfanyl-N-propylpyrimidin-2-amine
CID 80873237

Frequently Asked Questions

What is the IUPAC name of 4-(dimethoxymethyl)-N-propylpyrimidin-2-amine?
The IUPAC name of 4-(dimethoxymethyl)-N-propylpyrimidin-2-amine (CID 146441293) is 4-(dimethoxymethyl)-N-propylpyrimidin-2-amine.
What is the SMILES notation for 4-(dimethoxymethyl)-N-propylpyrimidin-2-amine?
The canonical SMILES for 4-(dimethoxymethyl)-N-propylpyrimidin-2-amine is CCCNc1nccc(C(OC)OC)n1.
What is the InChIKey of 4-(dimethoxymethyl)-N-propylpyrimidin-2-amine?
The InChIKey is OVZIDQHHOIVFPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O2/c1-4-6-11-10-12-7-5-8(13-10)9(14-2)15-3/h5,7,9H,4,6H2,1-3H3,(H,11,12,13).
What are the key properties of 4-(dimethoxymethyl)-N-propylpyrimidin-2-amine?
4-(dimethoxymethyl)-N-propylpyrimidin-2-amine has a molecular weight of 211.26 g/mol, XLogP of 1.59, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(dimethoxymethyl)-N-propylpyrimidin-2-amine is sourced from PubChem (CID 146441293), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).