5-ethyl-6-N-methyl-4-N-(1-morpholin-4-ylpropan-2-yl)pyrimidine-4,6-diamine

C14H25N5O — CID 80802012

IUPAC5-ethyl-6-N-methyl-4-N-(1-morpholin-4-ylpropan-2-yl)pyrimidine-4,6-diamine
SMILESCCc1c(NC)ncnc1NC(C)CN1CCOCC1
InChIInChI=1S/C14H25N5O/c1-4-12-13(15-3)16-10-17-14(12)18-11(2)9-19-5-7-20-8-6-19/h10-11H,4-9H2,1-3H3,(H2,15,16,17,18)
InChIKeyKNXBMJDBASFQPW-UHFFFAOYSA-N
MW279.39 g/mol
LogP1.21
Rot. Bonds6

About 5-ethyl-6-N-methyl-4-N-(1-morpholin-4-ylpropan-2-yl)pyrimidine-4,6-diamine

5-ethyl-6-N-methyl-4-N-(1-morpholin-4-ylpropan-2-yl)pyrimidine-4,6-diamine (PubChem CID 80802012) has the molecular formula C14H25N5O and a molecular weight of 279.39 g/mol. Its IUPAC name is 5-ethyl-6-N-methyl-4-N-(1-morpholin-4-ylpropan-2-yl)pyrimidine-4,6-diamine.

Molecular Properties

Compound Name5-ethyl-6-N-methyl-4-N-(1-morpholin-4-ylpropan-2-yl)pyrimidine-4,6-diamine
PubChem CID80802012
Molecular FormulaC14H25N5O
Molecular Weight279.39 g/mol
Exact Mass279.21
IUPAC Name5-ethyl-6-N-methyl-4-N-(1-morpholin-4-ylpropan-2-yl)pyrimidine-4,6-diamine
SMILESCCc1c(NC)ncnc1NC(C)CN1CCOCC1
InChIInChI=1S/C14H25N5O/c1-4-12-13(15-3)16-10-17-14(12)18-11(2)9-19-5-7-20-8-6-19/h10-11H,4-9H2,1-3H3,(H2,15,16,17,18)
InChIKeyKNXBMJDBASFQPW-UHFFFAOYSA-N
XLogP1.21
TPSA62.31 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.39
LogP ≤ 51.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

5-ethyl-4-N-hexan-2-yl-6-N-methylpyrimidine-4,6-diamine
CID 80822887
7-methyl-N-(1-morpholin-4-ylpropan-2-yl)thieno[3,2-d]pyrimidin-4-amine
CID 102686382
3-fluoro-N-(1-morpholin-4-ylpropan-2-yl)pyridin-2-amine
CID 62733426
2,5-dichloro-N-(1-morpholin-4-ylpropan-2-yl)pyrimidin-4-amine
CID 79633115
5-ethyl-4-N-[1-(furan-2-yl)propan-2-yl]-6-N-methylpyrimidine-4,6-diamine
CID 80802948
3-iodo-N-(1-morpholin-4-ylpropan-2-yl)pyridin-2-amine
CID 75373063
N-[(2S)-1-morpholin-4-ylpropan-2-yl]pyrimidin-4-amine
CID 94220826
6-hydrazinyl-5-propyl-N-(1-pyrrolidin-1-ylpropan-2-yl)pyrimidin-4-amine
CID 80897473
6-chloro-5-propyl-N-(1-pyrrolidin-1-ylpropan-2-yl)pyrimidin-4-amine
CID 63728295
6-chloro-N-(1-piperidin-1-ylpropan-2-yl)-5-propylpyrimidin-4-amine
CID 63729469
N-(1-morpholin-4-ylpropan-2-yl)-6-pyrrolidin-1-ylpyrimidin-4-amine
CID 133291179
4-N-[1-(4-bromophenyl)ethyl]-5-ethyl-6-N-methylpyrimidine-4,6-diamine
CID 80801411

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-6-N-methyl-4-N-(1-morpholin-4-ylpropan-2-yl)pyrimidine-4,6-diamine?
The IUPAC name of 5-ethyl-6-N-methyl-4-N-(1-morpholin-4-ylpropan-2-yl)pyrimidine-4,6-diamine (CID 80802012) is 5-ethyl-6-N-methyl-4-N-(1-morpholin-4-ylpropan-2-yl)pyrimidine-4,6-diamine.
What is the SMILES notation for 5-ethyl-6-N-methyl-4-N-(1-morpholin-4-ylpropan-2-yl)pyrimidine-4,6-diamine?
The canonical SMILES for 5-ethyl-6-N-methyl-4-N-(1-morpholin-4-ylpropan-2-yl)pyrimidine-4,6-diamine is CCc1c(NC)ncnc1NC(C)CN1CCOCC1.
What is the InChIKey of 5-ethyl-6-N-methyl-4-N-(1-morpholin-4-ylpropan-2-yl)pyrimidine-4,6-diamine?
The InChIKey is KNXBMJDBASFQPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N5O/c1-4-12-13(15-3)16-10-17-14(12)18-11(2)9-19-5-7-20-8-6-19/h10-11H,4-9H2,1-3H3,(H2,15,16,17,18).
What are the key properties of 5-ethyl-6-N-methyl-4-N-(1-morpholin-4-ylpropan-2-yl)pyrimidine-4,6-diamine?
5-ethyl-6-N-methyl-4-N-(1-morpholin-4-ylpropan-2-yl)pyrimidine-4,6-diamine has a molecular weight of 279.39 g/mol, XLogP of 1.21, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-6-N-methyl-4-N-(1-morpholin-4-ylpropan-2-yl)pyrimidine-4,6-diamine is sourced from PubChem (CID 80802012), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).