N-methyl-N-[(1S)-1-(1-methylpyrazol-4-yl)ethyl]-6-morpholin-4-ylpyrimidin-4-amine

C15H22N6O — CID 129320707

IUPACN-methyl-N-[(1S)-1-(1-methylpyrazol-4-yl)ethyl]-6-morpholin-4-ylpyrimidin-4-amine
SMILESC[C@@H](c1cnn(C)c1)N(C)c1cc(N2CCOCC2)ncn1
InChIInChI=1S/C15H22N6O/c1-12(13-9-18-19(2)10-13)20(3)14-8-15(17-11-16-14)21-4-6-22-7-5-21/h8-12H,4-7H2,1-3H3/t12-/m0/s1
InChIKeySYKYWAFPECVVQO-LBPRGKRZSA-N
MW302.38 g/mol
LogP1.24
Rot. Bonds4

About N-methyl-N-[(1S)-1-(1-methylpyrazol-4-yl)ethyl]-6-morpholin-4-ylpyrimidin-4-amine

N-methyl-N-[(1S)-1-(1-methylpyrazol-4-yl)ethyl]-6-morpholin-4-ylpyrimidin-4-amine (PubChem CID 129320707) has the molecular formula C15H22N6O and a molecular weight of 302.38 g/mol. Its IUPAC name is N-methyl-N-[(1S)-1-(1-methylpyrazol-4-yl)ethyl]-6-morpholin-4-ylpyrimidin-4-amine.

Molecular Properties

Compound NameN-methyl-N-[(1S)-1-(1-methylpyrazol-4-yl)ethyl]-6-morpholin-4-ylpyrimidin-4-amine
PubChem CID129320707
Molecular FormulaC15H22N6O
Molecular Weight302.38 g/mol
Exact Mass302.19
IUPAC NameN-methyl-N-[(1S)-1-(1-methylpyrazol-4-yl)ethyl]-6-morpholin-4-ylpyrimidin-4-amine
SMILESC[C@@H](c1cnn(C)c1)N(C)c1cc(N2CCOCC2)ncn1
InChIInChI=1S/C15H22N6O/c1-12(13-9-18-19(2)10-13)20(3)14-8-15(17-11-16-14)21-4-6-22-7-5-21/h8-12H,4-7H2,1-3H3/t12-/m0/s1
InChIKeySYKYWAFPECVVQO-LBPRGKRZSA-N
XLogP1.24
TPSA59.31 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.38
LogP ≤ 51.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Related Compounds

4-(6-Pyrazol-1-ylpyrimidin-4-yl)morpholine
CID 661544
N-[(2-morpholin-4-ylpyrimidin-5-yl)methyl]-2-pyrazol-1-ylethanamine
CID 56817472
(4aR,7aS)-6-[(1-methylpyrazol-4-yl)methyl]-4-pyrimidin-2-yl-2,3,4a,5,7,7a-hexahydropyrrolo[3,4-b][1,4]oxazine
CID 97377521
(3S)-3-methyl-4-(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)morpholine
CID 32810016
N-methyl-N-[3-(1-methyl-1H-pyrazol-4-yl)propyl]-6-morpholin-4-ylpyrimidin-4-amine
CID 50952043
4-N-butyl-6-[(2R)-2-(1-ethylpyrazol-4-yl)morpholin-4-yl]pyrimidine-2,4-diamine
CID 100646624
4-[2-(1-ethyl-1H-pyrazol-5-yl)-5-fluoropyrimidin-4-yl]morpholine
CID 121496357
N-methyl-1-(3-methyl-1H-pyrazol-4-yl)-N-[(2-morpholin-4-ylpyrimidin-5-yl)methyl]methanamine
CID 124209890
2-({6-[[(1-ethyl-5-methyl-1H-pyrazol-4-yl)methyl](methyl)amino]pyrimidin-4-yl}amino)ethanol
CID 132411042
N,N-dimethyl-4-[(2R)-2-(pyrazol-1-ylmethyl)morpholin-4-yl]pyrimidin-2-amine
CID 164639660
2-[3-(Trifluoromethyl)-1H-pyrazole-1-yl]-4-morpholino-6-methylpyrimidine
CID 11335968
4-[2-(3-Fluoropyrazol-1-yl)-6-methylpyrimidin-4-yl]morpholine
CID 57806055

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[(1S)-1-(1-methylpyrazol-4-yl)ethyl]-6-morpholin-4-ylpyrimidin-4-amine?
The IUPAC name of N-methyl-N-[(1S)-1-(1-methylpyrazol-4-yl)ethyl]-6-morpholin-4-ylpyrimidin-4-amine (CID 129320707) is N-methyl-N-[(1S)-1-(1-methylpyrazol-4-yl)ethyl]-6-morpholin-4-ylpyrimidin-4-amine.
What is the SMILES notation for N-methyl-N-[(1S)-1-(1-methylpyrazol-4-yl)ethyl]-6-morpholin-4-ylpyrimidin-4-amine?
The canonical SMILES for N-methyl-N-[(1S)-1-(1-methylpyrazol-4-yl)ethyl]-6-morpholin-4-ylpyrimidin-4-amine is C[C@@H](c1cnn(C)c1)N(C)c1cc(N2CCOCC2)ncn1.
What is the InChIKey of N-methyl-N-[(1S)-1-(1-methylpyrazol-4-yl)ethyl]-6-morpholin-4-ylpyrimidin-4-amine?
The InChIKey is SYKYWAFPECVVQO-LBPRGKRZSA-N. The full InChI is InChI=1S/C15H22N6O/c1-12(13-9-18-19(2)10-13)20(3)14-8-15(17-11-16-14)21-4-6-22-7-5-21/h8-12H,4-7H2,1-3H3/t12-/m0/s1.
What are the key properties of N-methyl-N-[(1S)-1-(1-methylpyrazol-4-yl)ethyl]-6-morpholin-4-ylpyrimidin-4-amine?
N-methyl-N-[(1S)-1-(1-methylpyrazol-4-yl)ethyl]-6-morpholin-4-ylpyrimidin-4-amine has a molecular weight of 302.38 g/mol, XLogP of 1.24, 4 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[(1S)-1-(1-methylpyrazol-4-yl)ethyl]-6-morpholin-4-ylpyrimidin-4-amine is sourced from PubChem (CID 129320707), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).