N-[[6-(1-ethylpyrazol-4-yl)oxy-5-methyl-3-pyridinyl]methyl]cyclopropanamine

C15H20N4O — CID 116802203

IUPACN-[[6-(1-ethylpyrazol-4-yl)oxy-5-methyl-3-pyridinyl]methyl]cyclopropanamine
SMILESCCn1cc(Oc2ncc(CNC3CC3)cc2C)cn1
InChIInChI=1S/C15H20N4O/c1-3-19-10-14(9-18-19)20-15-11(2)6-12(8-17-15)7-16-13-4-5-13/h6,8-10,13,16H,3-5,7H2,1-2H3
InChIKeyNAZGJCDHOGFIRO-UHFFFAOYSA-N
MW272.35 g/mol
LogP2.65
Rot. Bonds6

About N-[[6-(1-ethylpyrazol-4-yl)oxy-5-methyl-3-pyridinyl]methyl]cyclopropanamine

N-[[6-(1-ethylpyrazol-4-yl)oxy-5-methyl-3-pyridinyl]methyl]cyclopropanamine (PubChem CID 116802203) has the molecular formula C15H20N4O and a molecular weight of 272.35 g/mol. Its IUPAC name is N-[[6-(1-ethylpyrazol-4-yl)oxy-5-methyl-3-pyridinyl]methyl]cyclopropanamine.

Molecular Properties

Compound NameN-[[6-(1-ethylpyrazol-4-yl)oxy-5-methyl-3-pyridinyl]methyl]cyclopropanamine
PubChem CID116802203
Molecular FormulaC15H20N4O
Molecular Weight272.35 g/mol
Exact Mass272.16
IUPAC NameN-[[6-(1-ethylpyrazol-4-yl)oxy-5-methyl-3-pyridinyl]methyl]cyclopropanamine
SMILESCCn1cc(Oc2ncc(CNC3CC3)cc2C)cn1
InChIInChI=1S/C15H20N4O/c1-3-19-10-14(9-18-19)20-15-11(2)6-12(8-17-15)7-16-13-4-5-13/h6,8-10,13,16H,3-5,7H2,1-2H3
InChIKeyNAZGJCDHOGFIRO-UHFFFAOYSA-N
XLogP2.65
TPSA51.97 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.35
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[[6-(3,5-dimethylphenoxy)-5-methyl-3-pyridinyl]methyl]cyclopropanamine
CID 80636921
N-[[6-(4-chlorophenoxy)-5-methyl-3-pyridinyl]methyl]cyclopropanamine
CID 80636342
N-methyl-1-[5-methyl-6-(1-methylpyrazol-4-yl)oxy-3-pyridinyl]methanamine
CID 116793108
N-[[6-(5-chloro-2-methylphenoxy)-5-methyl-3-pyridinyl]methyl]cyclopropanamine
CID 80639084
N-[(1-ethylpyrazol-4-yl)methyl]cyclooctanamine
CID 62126333
2-[5-methyl-6-(1-propylpyrazol-4-yl)oxy-3-pyridinyl]ethanamine
CID 116804222
N-[[5-chloro-6-(4-methylphenoxy)-3-pyridinyl]methyl]cyclopropanamine
CID 62295657
3-bromo-2-(1-ethylpyrazol-4-yl)oxy-4-methylpyridine
CID 106878112
N-[(1-ethylpyrazol-4-yl)methyl]oxan-4-amine
CID 62125824
N-[3-(1-ethylpyrazol-4-yl)oxypropyl]cyclohexanamine
CID 116803738
N-[2-[2-[(1-ethylpyrazol-4-yl)oxymethyl]phenyl]ethyl]cyclopropanamine
CID 116803262
N-[[5-[(1-propylpyrazol-4-yl)oxymethyl]furan-3-yl]methyl]cyclopropanamine
CID 116803383

Frequently Asked Questions

What is the IUPAC name of N-[[6-(1-ethylpyrazol-4-yl)oxy-5-methyl-3-pyridinyl]methyl]cyclopropanamine?
The IUPAC name of N-[[6-(1-ethylpyrazol-4-yl)oxy-5-methyl-3-pyridinyl]methyl]cyclopropanamine (CID 116802203) is N-[[6-(1-ethylpyrazol-4-yl)oxy-5-methyl-3-pyridinyl]methyl]cyclopropanamine.
What is the SMILES notation for N-[[6-(1-ethylpyrazol-4-yl)oxy-5-methyl-3-pyridinyl]methyl]cyclopropanamine?
The canonical SMILES for N-[[6-(1-ethylpyrazol-4-yl)oxy-5-methyl-3-pyridinyl]methyl]cyclopropanamine is CCn1cc(Oc2ncc(CNC3CC3)cc2C)cn1.
What is the InChIKey of N-[[6-(1-ethylpyrazol-4-yl)oxy-5-methyl-3-pyridinyl]methyl]cyclopropanamine?
The InChIKey is NAZGJCDHOGFIRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4O/c1-3-19-10-14(9-18-19)20-15-11(2)6-12(8-17-15)7-16-13-4-5-13/h6,8-10,13,16H,3-5,7H2,1-2H3.
What are the key properties of N-[[6-(1-ethylpyrazol-4-yl)oxy-5-methyl-3-pyridinyl]methyl]cyclopropanamine?
N-[[6-(1-ethylpyrazol-4-yl)oxy-5-methyl-3-pyridinyl]methyl]cyclopropanamine has a molecular weight of 272.35 g/mol, XLogP of 2.65, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[6-(1-ethylpyrazol-4-yl)oxy-5-methyl-3-pyridinyl]methyl]cyclopropanamine is sourced from PubChem (CID 116802203), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).