N,N-dimethyl-5-[[2-[6-[(2-methylphenyl)methyl]-2-pyridinyl]morpholin-4-yl]methyl]pyrimidin-2-amine

C24H29N5O — CID 127249995

IUPACN,N-dimethyl-5-[[2-[6-[(2-methylphenyl)methyl]-2-pyridinyl]morpholin-4-yl]methyl]pyrimidin-2-amine
SMILESCc1ccccc1Cc1cccc(C2CN(Cc3cnc(N(C)C)nc3)CCO2)n1
InChIInChI=1S/C24H29N5O/c1-18-7-4-5-8-20(18)13-21-9-6-10-22(27-21)23-17-29(11-12-30-23)16-19-14-25-24(26-15-19)28(2)3/h4-10,14-15,23H,11-13,16-17H2,1-3H3
InChIKeyGSMFLVXEFLUJFS-UHFFFAOYSA-N
MW403.53 g/mol
LogP3.41
Rot. Bonds6

About N,N-dimethyl-5-[[2-[6-[(2-methylphenyl)methyl]-2-pyridinyl]morpholin-4-yl]methyl]pyrimidin-2-amine

N,N-dimethyl-5-[[2-[6-[(2-methylphenyl)methyl]-2-pyridinyl]morpholin-4-yl]methyl]pyrimidin-2-amine (PubChem CID 127249995) has the molecular formula C24H29N5O and a molecular weight of 403.53 g/mol. Its IUPAC name is N,N-dimethyl-5-[[2-[6-[(2-methylphenyl)methyl]-2-pyridinyl]morpholin-4-yl]methyl]pyrimidin-2-amine.

Molecular Properties

Compound NameN,N-dimethyl-5-[[2-[6-[(2-methylphenyl)methyl]-2-pyridinyl]morpholin-4-yl]methyl]pyrimidin-2-amine
PubChem CID127249995
Molecular FormulaC24H29N5O
Molecular Weight403.53 g/mol
Exact Mass403.24
IUPAC NameN,N-dimethyl-5-[[2-[6-[(2-methylphenyl)methyl]-2-pyridinyl]morpholin-4-yl]methyl]pyrimidin-2-amine
SMILESCc1ccccc1Cc1cccc(C2CN(Cc3cnc(N(C)C)nc3)CCO2)n1
InChIInChI=1S/C24H29N5O/c1-18-7-4-5-8-20(18)13-21-9-6-10-22(27-21)23-17-29(11-12-30-23)16-19-14-25-24(26-15-19)28(2)3/h4-10,14-15,23H,11-13,16-17H2,1-3H3
InChIKeyGSMFLVXEFLUJFS-UHFFFAOYSA-N
XLogP3.41
TPSA54.38 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500403.53
LogP ≤ 53.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze N,N-dimethyl-5-[[2-[6-[(2-methylphenyl)methyl]-2-pyridinyl]morpholin-4-yl]methyl]pyrimidin-2-amine with MolForge

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Launch Full Analysis

Related Compounds

(2S)-2-[6-[(2-methylphenyl)methyl]-2-pyridinyl]-4-[(1-methylpyrazol-4-yl)methyl]morpholine
CID 124968837
(2R)-4-[(1,5-dimethylpyrazol-4-yl)methyl]-2-[6-[(2-methylphenyl)methyl]-2-pyridinyl]morpholine
CID 125016910
(2R)-2-[6-[(2-methylphenyl)methyl]-2-pyridinyl]-4-pyrimidin-2-ylmorpholine
CID 124963422
N,N-dimethyl-5-[[(2R)-2-(4-methylpyrimidin-2-yl)morpholin-4-yl]methyl]pyrimidin-2-amine
CID 124964770
(2S)-2-[6-[(2-chlorophenyl)methyl]-2-pyridinyl]-4-[(2-methyl-1,3-thiazol-5-yl)methyl]morpholine
CID 124949958
3-[6-[(2R)-4-[[2-(dimethylamino)pyrimidin-5-yl]methyl]morpholin-2-yl]-2-pyridinyl]benzamide
CID 124956411
4-[4-[[2-(dimethylamino)pyrimidin-5-yl]methyl]morpholin-2-yl]-2-methyl-1H-pyrimidin-6-one
CID 136844457
(2R)-4-(pyridin-3-ylmethyl)-2-[6-[[2-(trifluoromethyl)phenyl]methyl]-2-pyridinyl]morpholine
CID 125008958
(2R)-2-(6-benzyl-2-pyridinyl)-4-[(1-ethylpyrazol-4-yl)methyl]morpholine
CID 124974858
5-[[(2S)-2-(3,4-dichlorophenyl)morpholin-4-yl]methyl]-N,N-dimethylpyrimidin-2-amine
CID 95558901
(2S)-2-[6-methyl-4-[(2-methylphenyl)methyl]-2-pyridinyl]-4-[(1-methylpyrazol-4-yl)methyl]morpholine
CID 124949780
6-[4-[(2-methoxypyrimidin-5-yl)methyl]morpholin-2-yl]-N-methylpyridin-2-amine
CID 110112420

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-5-[[2-[6-[(2-methylphenyl)methyl]-2-pyridinyl]morpholin-4-yl]methyl]pyrimidin-2-amine?
The IUPAC name of N,N-dimethyl-5-[[2-[6-[(2-methylphenyl)methyl]-2-pyridinyl]morpholin-4-yl]methyl]pyrimidin-2-amine (CID 127249995) is N,N-dimethyl-5-[[2-[6-[(2-methylphenyl)methyl]-2-pyridinyl]morpholin-4-yl]methyl]pyrimidin-2-amine.
What is the SMILES notation for N,N-dimethyl-5-[[2-[6-[(2-methylphenyl)methyl]-2-pyridinyl]morpholin-4-yl]methyl]pyrimidin-2-amine?
The canonical SMILES for N,N-dimethyl-5-[[2-[6-[(2-methylphenyl)methyl]-2-pyridinyl]morpholin-4-yl]methyl]pyrimidin-2-amine is Cc1ccccc1Cc1cccc(C2CN(Cc3cnc(N(C)C)nc3)CCO2)n1.
What is the InChIKey of N,N-dimethyl-5-[[2-[6-[(2-methylphenyl)methyl]-2-pyridinyl]morpholin-4-yl]methyl]pyrimidin-2-amine?
The InChIKey is GSMFLVXEFLUJFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H29N5O/c1-18-7-4-5-8-20(18)13-21-9-6-10-22(27-21)23-17-29(11-12-30-23)16-19-14-25-24(26-15-19)28(2)3/h4-10,14-15,23H,11-13,16-17H2,1-3H3.
What are the key properties of N,N-dimethyl-5-[[2-[6-[(2-methylphenyl)methyl]-2-pyridinyl]morpholin-4-yl]methyl]pyrimidin-2-amine?
N,N-dimethyl-5-[[2-[6-[(2-methylphenyl)methyl]-2-pyridinyl]morpholin-4-yl]methyl]pyrimidin-2-amine has a molecular weight of 403.53 g/mol, XLogP of 3.41, 6 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-5-[[2-[6-[(2-methylphenyl)methyl]-2-pyridinyl]morpholin-4-yl]methyl]pyrimidin-2-amine is sourced from PubChem (CID 127249995), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).