N-cycloheptyl-6-methyl-2-morpholin-4-ylpyrimidin-4-amine

C16H26N4O — CID 112912292

IUPACN-cycloheptyl-6-methyl-2-morpholin-4-ylpyrimidin-4-amine
SMILESCc1cc(NC2CCCCCC2)nc(N2CCOCC2)n1
InChIInChI=1S/C16H26N4O/c1-13-12-15(18-14-6-4-2-3-5-7-14)19-16(17-13)20-8-10-21-11-9-20/h12,14H,2-11H2,1H3,(H,17,18,19)
InChIKeyREMXDRCOMQZBQQ-UHFFFAOYSA-N
MW290.41 g/mol
LogP2.76
Rot. Bonds3

About N-cycloheptyl-6-methyl-2-morpholin-4-ylpyrimidin-4-amine

N-cycloheptyl-6-methyl-2-morpholin-4-ylpyrimidin-4-amine (PubChem CID 112912292) has the molecular formula C16H26N4O and a molecular weight of 290.41 g/mol. Its IUPAC name is N-cycloheptyl-6-methyl-2-morpholin-4-ylpyrimidin-4-amine.

Molecular Properties

Compound NameN-cycloheptyl-6-methyl-2-morpholin-4-ylpyrimidin-4-amine
PubChem CID112912292
Molecular FormulaC16H26N4O
Molecular Weight290.41 g/mol
Exact Mass290.21
IUPAC NameN-cycloheptyl-6-methyl-2-morpholin-4-ylpyrimidin-4-amine
SMILESCc1cc(NC2CCCCCC2)nc(N2CCOCC2)n1
InChIInChI=1S/C16H26N4O/c1-13-12-15(18-14-6-4-2-3-5-7-14)19-16(17-13)20-8-10-21-11-9-20/h12,14H,2-11H2,1H3,(H,17,18,19)
InChIKeyREMXDRCOMQZBQQ-UHFFFAOYSA-N
XLogP2.76
TPSA50.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 52.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-(azetidin-1-yl)-6-methyl-N-(oxetan-3-yl)pyrimidin-4-amine
CID 90245533
2-[4-(3-chlorophenyl)piperazin-1-yl]-N-cyclopentyl-6-methylpyrimidin-4-amine
CID 112909661
N-cyclohexyl-6-methyl-2-morpholin-4-ylpyrimidine-4-carboxamide
CID 56731255
N-(3,5-dimethylphenyl)-6-methyl-2-morpholin-4-ylpyrimidin-4-amine
CID 112912311
2-(4-ethylpiperazin-1-yl)-6-methyl-N-(oxetan-3-yl)pyrimidin-4-amine
CID 118549633
2-chloro-N-cyclooctyl-6-methylpyrimidin-4-amine
CID 62477966
N-cycloheptyl-2-(3,4-dihydro-2H-quinolin-1-yl)-6-methylpyrimidin-4-amine
CID 112924885
6-methyl-2-morpholin-4-yl-N-(pyridin-2-ylmethyl)pyrimidin-4-amine
CID 112912256
[2-(cyclobutylamino)-6-morpholin-4-yl-4-pyridinyl]-trimethylazanium
CID 123635147
4-N-cyclopropyl-6-methyl-2-N-(2-morpholin-4-ylphenyl)pyrimidine-2,4-diamine
CID 112907508
N-[2-(4-methoxyphenoxy)ethyl]-6-methyl-2-morpholin-4-ylpyrimidin-4-amine
CID 112912289
N-(6-methyl-2-morpholin-4-ylpyrimidin-4-yl)quinolin-8-amine
CID 112912374

Frequently Asked Questions

What is the IUPAC name of N-cycloheptyl-6-methyl-2-morpholin-4-ylpyrimidin-4-amine?
The IUPAC name of N-cycloheptyl-6-methyl-2-morpholin-4-ylpyrimidin-4-amine (CID 112912292) is N-cycloheptyl-6-methyl-2-morpholin-4-ylpyrimidin-4-amine.
What is the SMILES notation for N-cycloheptyl-6-methyl-2-morpholin-4-ylpyrimidin-4-amine?
The canonical SMILES for N-cycloheptyl-6-methyl-2-morpholin-4-ylpyrimidin-4-amine is Cc1cc(NC2CCCCCC2)nc(N2CCOCC2)n1.
What is the InChIKey of N-cycloheptyl-6-methyl-2-morpholin-4-ylpyrimidin-4-amine?
The InChIKey is REMXDRCOMQZBQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N4O/c1-13-12-15(18-14-6-4-2-3-5-7-14)19-16(17-13)20-8-10-21-11-9-20/h12,14H,2-11H2,1H3,(H,17,18,19).
What are the key properties of N-cycloheptyl-6-methyl-2-morpholin-4-ylpyrimidin-4-amine?
N-cycloheptyl-6-methyl-2-morpholin-4-ylpyrimidin-4-amine has a molecular weight of 290.41 g/mol, XLogP of 2.76, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cycloheptyl-6-methyl-2-morpholin-4-ylpyrimidin-4-amine is sourced from PubChem (CID 112912292), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).