4-N,4-N-dimethyl-6-N-[[(2R)-oxolan-2-yl]methyl]pyrimidine-4,6-diamine

C11H18N4O — CID 39834385

IUPAC4-N,4-N-dimethyl-6-N-[[(2R)-oxolan-2-yl]methyl]pyrimidine-4,6-diamine
SMILESCN(C)c1cc(NC[C@H]2CCCO2)ncn1
InChIInChI=1S/C11H18N4O/c1-15(2)11-6-10(13-8-14-11)12-7-9-4-3-5-16-9/h6,8-9H,3-5,7H2,1-2H3,(H,12,13,14)/t9-/m1/s1
InChIKeyLPHVDLVKTKGCTO-SECBINFHSA-N
MW222.29 g/mol
LogP1.13
Rot. Bonds4

About 4-N,4-N-dimethyl-6-N-[[(2R)-oxolan-2-yl]methyl]pyrimidine-4,6-diamine

4-N,4-N-dimethyl-6-N-[[(2R)-oxolan-2-yl]methyl]pyrimidine-4,6-diamine (PubChem CID 39834385) has the molecular formula C11H18N4O and a molecular weight of 222.29 g/mol. Its IUPAC name is 4-N,4-N-dimethyl-6-N-[[(2R)-oxolan-2-yl]methyl]pyrimidine-4,6-diamine.

Molecular Properties

Compound Name4-N,4-N-dimethyl-6-N-[[(2R)-oxolan-2-yl]methyl]pyrimidine-4,6-diamine
PubChem CID39834385
Molecular FormulaC11H18N4O
Molecular Weight222.29 g/mol
Exact Mass222.15
IUPAC Name4-N,4-N-dimethyl-6-N-[[(2R)-oxolan-2-yl]methyl]pyrimidine-4,6-diamine
SMILESCN(C)c1cc(NC[C@H]2CCCO2)ncn1
InChIInChI=1S/C11H18N4O/c1-15(2)11-6-10(13-8-14-11)12-7-9-4-3-5-16-9/h6,8-9H,3-5,7H2,1-2H3,(H,12,13,14)/t9-/m1/s1
InChIKeyLPHVDLVKTKGCTO-SECBINFHSA-N
XLogP1.13
TPSA50.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.29
LogP ≤ 51.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 4-N,4-N-dimethyl-6-N-[[(2R)-oxolan-2-yl]methyl]pyrimidine-4,6-diamine with MolForge

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Related Compounds

2-chloro-N-((tetrahydrofuran-2-yl)methyl)pyrimidin-4-amine
CID 4778956
rac-4-[(3R,4S)-3-amino-4-methoxypyrrolidin-1-yl]-N-methylpyrimidin-2-amine
CID 145874812
[1-[6-(1-Morpholin-4-ylpropan-2-ylamino)pyrimidin-4-yl]pyrrolidin-2-yl]methanol
CID 72144609
N-{3-[(2R*,6S*)-2,6-dimethylmorpholin-4-yl]propyl}pyrimidin-4-amine
CID 72884079
6-N-cyclopropyl-4-N-methyl-4-N-[[(2R)-oxan-2-yl]methyl]pyrimidine-2,4,6-triamine
CID 95122020
6-(2,6-dimethylmorpholino)-N,N-dimethylpyrimidin-4-amine
CID 121020739
N~2~-[3-(cyclopentyloxy)propyl]-N~4~-methylpyrimidine-2,4-diamine
CID 122572139
1-[6-(Dimethylamino)pyrimidin-4-yl]-3-(2,3-dimethyloxolan-3-yl)urea
CID 128447596
2-methyl-N-[2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)ethyl]pyrimidin-4-amine
CID 128564520
6-N-(cyclopropylmethyl)-4-N-[[(2S,4S)-4-methoxy-1-methylpyrrolidin-2-yl]methyl]-4-N-methylpyrimidine-4,6-diamine
CID 128979215
6-[3-(dimethylamino)piperidin-1-yl]-N-(oxan-3-yl)pyrimidin-4-amine
CID 128997014
2-N,4-N-bis[(1S,2S)-2-methoxycyclopentyl]pyrimidine-2,4-diamine
CID 164638257

Frequently Asked Questions

What is the IUPAC name of 4-N,4-N-dimethyl-6-N-[[(2R)-oxolan-2-yl]methyl]pyrimidine-4,6-diamine?
The IUPAC name of 4-N,4-N-dimethyl-6-N-[[(2R)-oxolan-2-yl]methyl]pyrimidine-4,6-diamine (CID 39834385) is 4-N,4-N-dimethyl-6-N-[[(2R)-oxolan-2-yl]methyl]pyrimidine-4,6-diamine.
What is the SMILES notation for 4-N,4-N-dimethyl-6-N-[[(2R)-oxolan-2-yl]methyl]pyrimidine-4,6-diamine?
The canonical SMILES for 4-N,4-N-dimethyl-6-N-[[(2R)-oxolan-2-yl]methyl]pyrimidine-4,6-diamine is CN(C)c1cc(NC[C@H]2CCCO2)ncn1.
What is the InChIKey of 4-N,4-N-dimethyl-6-N-[[(2R)-oxolan-2-yl]methyl]pyrimidine-4,6-diamine?
The InChIKey is LPHVDLVKTKGCTO-SECBINFHSA-N. The full InChI is InChI=1S/C11H18N4O/c1-15(2)11-6-10(13-8-14-11)12-7-9-4-3-5-16-9/h6,8-9H,3-5,7H2,1-2H3,(H,12,13,14)/t9-/m1/s1.
What are the key properties of 4-N,4-N-dimethyl-6-N-[[(2R)-oxolan-2-yl]methyl]pyrimidine-4,6-diamine?
4-N,4-N-dimethyl-6-N-[[(2R)-oxolan-2-yl]methyl]pyrimidine-4,6-diamine has a molecular weight of 222.29 g/mol, XLogP of 1.13, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N,4-N-dimethyl-6-N-[[(2R)-oxolan-2-yl]methyl]pyrimidine-4,6-diamine is sourced from PubChem (CID 39834385), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).