N-[(2-methylpyrazol-3-yl)methyl]-5,6,7,8-tetrahydronaphthalen-1-amine

C15H19N3 — CID 43663157

IUPACN-[(2-methylpyrazol-3-yl)methyl]-5,6,7,8-tetrahydronaphthalen-1-amine
SMILESCn1nccc1CNc1cccc2c1CCCC2
InChIInChI=1S/C15H19N3/c1-18-13(9-10-17-18)11-16-15-8-4-6-12-5-2-3-7-14(12)15/h4,6,8-10,16H,2-3,5,7,11H2,1H3
InChIKeyYVZXXMKHVRCPKI-UHFFFAOYSA-N
MW241.34 g/mol
LogP2.91
Rot. Bonds3

About N-[(2-methylpyrazol-3-yl)methyl]-5,6,7,8-tetrahydronaphthalen-1-amine

N-[(2-methylpyrazol-3-yl)methyl]-5,6,7,8-tetrahydronaphthalen-1-amine (PubChem CID 43663157) has the molecular formula C15H19N3 and a molecular weight of 241.34 g/mol. Its IUPAC name is N-[(2-methylpyrazol-3-yl)methyl]-5,6,7,8-tetrahydronaphthalen-1-amine.

Molecular Properties

Compound NameN-[(2-methylpyrazol-3-yl)methyl]-5,6,7,8-tetrahydronaphthalen-1-amine
PubChem CID43663157
Molecular FormulaC15H19N3
Molecular Weight241.34 g/mol
Exact Mass241.16
IUPAC NameN-[(2-methylpyrazol-3-yl)methyl]-5,6,7,8-tetrahydronaphthalen-1-amine
SMILESCn1nccc1CNc1cccc2c1CCCC2
InChIInChI=1S/C15H19N3/c1-18-13(9-10-17-18)11-16-15-8-4-6-12-5-2-3-7-14(12)15/h4,6,8-10,16H,2-3,5,7,11H2,1H3
InChIKeyYVZXXMKHVRCPKI-UHFFFAOYSA-N
XLogP2.91
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.34
LogP ≤ 52.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(2-methylpyrazol-3-yl)ethyl]-5,6,7,8-tetrahydronaphthalen-1-amine
CID 103000564
N-[(3-propylimidazol-4-yl)methyl]-5,6,7,8-tetrahydronaphthalen-1-amine
CID 66132713
N-[(1-methylpyrazol-3-yl)methyl]-5,6,7,8-tetrahydronaphthalen-1-amine
CID 79478733
N-[(3-propan-2-ylimidazol-4-yl)methyl]-5,6,7,8-tetrahydronaphthalen-1-amine
CID 66130072
N-[(2-methylpyrazol-3-yl)methyl]-2-pyrrolidin-1-ylaniline
CID 43684265
2-[(2-methylpyrazol-3-yl)methylamino]benzonitrile
CID 43433440
2-[4-[(5,6,7,8-tetrahydronaphthalen-1-ylamino)methyl]pyrazol-1-yl]ethanol
CID 64828561
N-[(2-methylpyrazol-3-yl)methyl]-2-methylsulfonylaniline
CID 43724692
N-[2-(2-methylimidazol-1-yl)ethyl]-5,6,7,8-tetrahydronaphthalen-1-amine
CID 61492891
2,5-dimethyl-N-[(2-methylpyrazol-3-yl)methyl]aniline
CID 43663220
2-methoxy-N-[(2-methylpyrazol-3-yl)methyl]pyridin-3-amine
CID 43721974
N-butyl-5,6,7,8-tetrahydronaphthalen-1-amine
CID 43079025

Frequently Asked Questions

What is the IUPAC name of N-[(2-methylpyrazol-3-yl)methyl]-5,6,7,8-tetrahydronaphthalen-1-amine?
The IUPAC name of N-[(2-methylpyrazol-3-yl)methyl]-5,6,7,8-tetrahydronaphthalen-1-amine (CID 43663157) is N-[(2-methylpyrazol-3-yl)methyl]-5,6,7,8-tetrahydronaphthalen-1-amine.
What is the SMILES notation for N-[(2-methylpyrazol-3-yl)methyl]-5,6,7,8-tetrahydronaphthalen-1-amine?
The canonical SMILES for N-[(2-methylpyrazol-3-yl)methyl]-5,6,7,8-tetrahydronaphthalen-1-amine is Cn1nccc1CNc1cccc2c1CCCC2.
What is the InChIKey of N-[(2-methylpyrazol-3-yl)methyl]-5,6,7,8-tetrahydronaphthalen-1-amine?
The InChIKey is YVZXXMKHVRCPKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3/c1-18-13(9-10-17-18)11-16-15-8-4-6-12-5-2-3-7-14(12)15/h4,6,8-10,16H,2-3,5,7,11H2,1H3.
What are the key properties of N-[(2-methylpyrazol-3-yl)methyl]-5,6,7,8-tetrahydronaphthalen-1-amine?
N-[(2-methylpyrazol-3-yl)methyl]-5,6,7,8-tetrahydronaphthalen-1-amine has a molecular weight of 241.34 g/mol, XLogP of 2.91, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-methylpyrazol-3-yl)methyl]-5,6,7,8-tetrahydronaphthalen-1-amine is sourced from PubChem (CID 43663157), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).