1-naphthalen-2-yl-N-(1H-pyrazol-5-ylmethyl)methanamine

C15H15N3 — CID 61285657

IUPAC1-naphthalen-2-yl-N-(1H-pyrazol-5-ylmethyl)methanamine
SMILESc1ccc2cc(CNCc3ccn[nH]3)ccc2c1
InChIInChI=1S/C15H15N3/c1-2-4-14-9-12(5-6-13(14)3-1)10-16-11-15-7-8-17-18-15/h1-9,16H,10-11H2,(H,17,18)
InChIKeyUXNBHAWHGDAENE-UHFFFAOYSA-N
MW237.31 g/mol
LogP2.85
Rot. Bonds4

About 1-naphthalen-2-yl-N-(1H-pyrazol-5-ylmethyl)methanamine

1-naphthalen-2-yl-N-(1H-pyrazol-5-ylmethyl)methanamine (PubChem CID 61285657) has the molecular formula C15H15N3 and a molecular weight of 237.31 g/mol. Its IUPAC name is 1-naphthalen-2-yl-N-(1H-pyrazol-5-ylmethyl)methanamine.

Molecular Properties

Compound Name1-naphthalen-2-yl-N-(1H-pyrazol-5-ylmethyl)methanamine
PubChem CID61285657
Molecular FormulaC15H15N3
Molecular Weight237.31 g/mol
Exact Mass237.13
IUPAC Name1-naphthalen-2-yl-N-(1H-pyrazol-5-ylmethyl)methanamine
SMILESc1ccc2cc(CNCc3ccn[nH]3)ccc2c1
InChIInChI=1S/C15H15N3/c1-2-4-14-9-12(5-6-13(14)3-1)10-16-11-15-7-8-17-18-15/h1-9,16H,10-11H2,(H,17,18)
InChIKeyUXNBHAWHGDAENE-UHFFFAOYSA-N
XLogP2.85
TPSA40.71 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.31
LogP ≤ 52.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-(6-methoxynaphthalen-2-yl)-N-(1H-pyrazol-5-ylmethyl)methanamine
CID 61285857
1-(1H-pyrazol-5-yl)-N-(1H-pyrazol-5-ylmethyl)methanamine
CID 61285482
[3-[(1H-pyrazol-5-ylmethylamino)methyl]phenyl]methanol;hydrochloride
CID 115615868
2-[3-[(1H-pyrazol-5-ylmethylamino)methyl]phenoxy]acetonitrile
CID 61286262
1-(2-bromophenyl)-N-(1H-pyrazol-5-ylmethyl)methanamine
CID 61286252
N'-(naphthalen-2-ylmethyl)methanediamine
CID 115225812
1-(4-butoxyphenyl)-N-(1H-pyrazol-5-ylmethyl)methanamine
CID 61284679
(naphthalen-2-ylmethylamino)methanethiol
CID 115228012
1-(furan-3-yl)-N-(1H-pyrazol-5-ylmethyl)methanamine
CID 63001149
1-(2-fluorophenyl)-N-(1H-pyrazol-5-ylmethyl)methanamine
CID 43662344
N-ethyl-N-[[4-[(1H-pyrazol-5-ylmethylamino)methyl]phenyl]methyl]ethanamine
CID 43662461
N-(hydrazinylmethyl)-1-naphthalen-2-ylmethanamine
CID 115260879

Frequently Asked Questions

What is the IUPAC name of 1-naphthalen-2-yl-N-(1H-pyrazol-5-ylmethyl)methanamine?
The IUPAC name of 1-naphthalen-2-yl-N-(1H-pyrazol-5-ylmethyl)methanamine (CID 61285657) is 1-naphthalen-2-yl-N-(1H-pyrazol-5-ylmethyl)methanamine.
What is the SMILES notation for 1-naphthalen-2-yl-N-(1H-pyrazol-5-ylmethyl)methanamine?
The canonical SMILES for 1-naphthalen-2-yl-N-(1H-pyrazol-5-ylmethyl)methanamine is c1ccc2cc(CNCc3ccn[nH]3)ccc2c1.
What is the InChIKey of 1-naphthalen-2-yl-N-(1H-pyrazol-5-ylmethyl)methanamine?
The InChIKey is UXNBHAWHGDAENE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3/c1-2-4-14-9-12(5-6-13(14)3-1)10-16-11-15-7-8-17-18-15/h1-9,16H,10-11H2,(H,17,18).
What are the key properties of 1-naphthalen-2-yl-N-(1H-pyrazol-5-ylmethyl)methanamine?
1-naphthalen-2-yl-N-(1H-pyrazol-5-ylmethyl)methanamine has a molecular weight of 237.31 g/mol, XLogP of 2.85, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-naphthalen-2-yl-N-(1H-pyrazol-5-ylmethyl)methanamine is sourced from PubChem (CID 61285657), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).