1-(1-ethylpyrazol-4-yl)-N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-N-methylmethanamine

C16H24N4O — CID 131942745

IUPAC1-(1-ethylpyrazol-4-yl)-N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-N-methylmethanamine
SMILESCCn1cc(CN(C)Cc2ncc(C)c(OC)c2C)cn1
InChIInChI=1S/C16H24N4O/c1-6-20-10-14(8-18-20)9-19(4)11-15-13(3)16(21-5)12(2)7-17-15/h7-8,10H,6,9,11H2,1-5H3
InChIKeyMBFPCIQFQQEPAG-UHFFFAOYSA-N
MW288.40 g/mol
LogP2.56
Rot. Bonds6

About 1-(1-ethylpyrazol-4-yl)-N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-N-methylmethanamine

1-(1-ethylpyrazol-4-yl)-N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-N-methylmethanamine (PubChem CID 131942745) has the molecular formula C16H24N4O and a molecular weight of 288.40 g/mol. Its IUPAC name is 1-(1-ethylpyrazol-4-yl)-N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-N-methylmethanamine.

Molecular Properties

Compound Name1-(1-ethylpyrazol-4-yl)-N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-N-methylmethanamine
PubChem CID131942745
Molecular FormulaC16H24N4O
Molecular Weight288.40 g/mol
Exact Mass288.20
IUPAC Name1-(1-ethylpyrazol-4-yl)-N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-N-methylmethanamine
SMILESCCn1cc(CN(C)Cc2ncc(C)c(OC)c2C)cn1
InChIInChI=1S/C16H24N4O/c1-6-20-10-14(8-18-20)9-19(4)11-15-13(3)16(21-5)12(2)7-17-15/h7-8,10H,6,9,11H2,1-5H3
InChIKeyMBFPCIQFQQEPAG-UHFFFAOYSA-N
XLogP2.56
TPSA43.18 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.40
LogP ≤ 52.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 1-(1-ethylpyrazol-4-yl)-N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-N-methylmethanamine with MolForge

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Related Compounds

1-(1-ethylpyrazol-4-yl)-N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-N-methylmethanamine;formic acid
CID 154908656
2-[[4-(chloromethyl)pyrazol-1-yl]methyl]-4-methoxy-3,5-dimethylpyridine
CID 62729474
1-[1-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]pyrazol-4-yl]-N-methylmethanamine
CID 62731017
N'-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-N',2-dimethylpropane-1,3-diamine
CID 54991612
3-[[(1-ethylpyrazol-4-yl)methyl-methylamino]methyl]-5-methyl-1,2-oxazole-4-carboxylic acid
CID 138003915
4-[[(1-ethylpyrazol-4-yl)methyl-methylamino]methyl]aniline
CID 62127965
ethyl 3-[(1-ethylpyrazol-4-yl)methyl-methylamino]propanoate
CID 55040533
3-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl-methylamino]-2-methylpropanoic acid
CID 55007839
2-[[4-(1-chloropropyl)pyrazol-1-yl]methyl]-4-methoxy-3,5-dimethylpyridine
CID 62732030
1-(3-chloro-5-fluorophenyl)-N-[(1-ethylpyrazol-4-yl)methyl]-N-methylmethanamine
CID 77079167
3,4,5-trimethoxy-N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-N-methylbenzamide
CID 51128958
4-[[(1-ethylpyrazol-4-yl)methyl-methylamino]methyl]benzoic acid
CID 62126061

Frequently Asked Questions

What is the IUPAC name of 1-(1-ethylpyrazol-4-yl)-N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-N-methylmethanamine?
The IUPAC name of 1-(1-ethylpyrazol-4-yl)-N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-N-methylmethanamine (CID 131942745) is 1-(1-ethylpyrazol-4-yl)-N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-N-methylmethanamine.
What is the SMILES notation for 1-(1-ethylpyrazol-4-yl)-N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-N-methylmethanamine?
The canonical SMILES for 1-(1-ethylpyrazol-4-yl)-N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-N-methylmethanamine is CCn1cc(CN(C)Cc2ncc(C)c(OC)c2C)cn1.
What is the InChIKey of 1-(1-ethylpyrazol-4-yl)-N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-N-methylmethanamine?
The InChIKey is MBFPCIQFQQEPAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N4O/c1-6-20-10-14(8-18-20)9-19(4)11-15-13(3)16(21-5)12(2)7-17-15/h7-8,10H,6,9,11H2,1-5H3.
What are the key properties of 1-(1-ethylpyrazol-4-yl)-N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-N-methylmethanamine?
1-(1-ethylpyrazol-4-yl)-N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-N-methylmethanamine has a molecular weight of 288.40 g/mol, XLogP of 2.56, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-ethylpyrazol-4-yl)-N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-N-methylmethanamine is sourced from PubChem (CID 131942745), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).