(3-methoxyphenyl)-(2-propylpyrazol-3-yl)methanamine

C14H19N3O — CID 63974663

IUPAC(3-methoxyphenyl)-(2-propylpyrazol-3-yl)methanamine
SMILESCCCn1nccc1C(N)c1cccc(OC)c1
InChIInChI=1S/C14H19N3O/c1-3-9-17-13(7-8-16-17)14(15)11-5-4-6-12(10-11)18-2/h4-8,10,14H,3,9,15H2,1-2H3
InChIKeyDAPQFPSMNQXZLW-UHFFFAOYSA-N
MW245.33 g/mol
LogP2.35
Rot. Bonds5

About (3-methoxyphenyl)-(2-propylpyrazol-3-yl)methanamine

(3-methoxyphenyl)-(2-propylpyrazol-3-yl)methanamine (PubChem CID 63974663) has the molecular formula C14H19N3O and a molecular weight of 245.33 g/mol. Its IUPAC name is (3-methoxyphenyl)-(2-propylpyrazol-3-yl)methanamine.

Molecular Properties

Compound Name(3-methoxyphenyl)-(2-propylpyrazol-3-yl)methanamine
PubChem CID63974663
Molecular FormulaC14H19N3O
Molecular Weight245.33 g/mol
Exact Mass245.15
IUPAC Name(3-methoxyphenyl)-(2-propylpyrazol-3-yl)methanamine
SMILESCCCn1nccc1C(N)c1cccc(OC)c1
InChIInChI=1S/C14H19N3O/c1-3-9-17-13(7-8-16-17)14(15)11-5-4-6-12(10-11)18-2/h4-8,10,14H,3,9,15H2,1-2H3
InChIKeyDAPQFPSMNQXZLW-UHFFFAOYSA-N
XLogP2.35
TPSA53.07 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.33
LogP ≤ 52.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(2-bromo-5-methoxyphenyl)-(2-propylpyrazol-3-yl)methanamine
CID 105148079
(3-ethoxyphenyl)-(2-ethylpyrazol-3-yl)methanamine
CID 63975299
(3,4-dimethylphenyl)-(2-propylpyrazol-3-yl)methanamine
CID 115857375
(3,4-difluorophenyl)-(2-propylpyrazol-3-yl)methanamine
CID 63977003
(6-bromonaphthalen-2-yl)-(2-propylpyrazol-3-yl)methanamine
CID 115857744
(3-chloro-4-iodophenyl)-(2-propylpyrazol-3-yl)methanamine
CID 103215295
1,3-dihydro-2-benzofuran-5-yl-(2-propylpyrazol-3-yl)methanamine
CID 115857588
(4-tert-butylphenyl)-(2-propylpyrazol-3-yl)methanamine
CID 115857696
(5-methoxy-3-pyridinyl)-(2-propylpyrazol-3-yl)methanol
CID 114557064
(3-bromophenyl)-(2-ethylpyrazol-3-yl)methanamine
CID 63977430
[(2-bromo-5-methoxyphenyl)-(2-propylpyrazol-3-yl)methyl]hydrazine
CID 105307040
naphthalen-1-yl-(2-propylpyrazol-3-yl)methanamine
CID 63976392

Frequently Asked Questions

What is the IUPAC name of (3-methoxyphenyl)-(2-propylpyrazol-3-yl)methanamine?
The IUPAC name of (3-methoxyphenyl)-(2-propylpyrazol-3-yl)methanamine (CID 63974663) is (3-methoxyphenyl)-(2-propylpyrazol-3-yl)methanamine.
What is the SMILES notation for (3-methoxyphenyl)-(2-propylpyrazol-3-yl)methanamine?
The canonical SMILES for (3-methoxyphenyl)-(2-propylpyrazol-3-yl)methanamine is CCCn1nccc1C(N)c1cccc(OC)c1.
What is the InChIKey of (3-methoxyphenyl)-(2-propylpyrazol-3-yl)methanamine?
The InChIKey is DAPQFPSMNQXZLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O/c1-3-9-17-13(7-8-16-17)14(15)11-5-4-6-12(10-11)18-2/h4-8,10,14H,3,9,15H2,1-2H3.
What are the key properties of (3-methoxyphenyl)-(2-propylpyrazol-3-yl)methanamine?
(3-methoxyphenyl)-(2-propylpyrazol-3-yl)methanamine has a molecular weight of 245.33 g/mol, XLogP of 2.35, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3-methoxyphenyl)-(2-propylpyrazol-3-yl)methanamine is sourced from PubChem (CID 63974663), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).