2,2-dimethyl-N-[2-(4-methylpyrazol-1-yl)ethyl]-3,4-dihydro-1H-naphthalen-1-amine

C18H25N3 — CID 104577694

IUPAC2,2-dimethyl-N-[2-(4-methylpyrazol-1-yl)ethyl]-3,4-dihydro-1H-naphthalen-1-amine
SMILESCc1cnn(CCNC2c3ccccc3CCC2(C)C)c1
InChIInChI=1S/C18H25N3/c1-14-12-20-21(13-14)11-10-19-17-16-7-5-4-6-15(16)8-9-18(17,2)3/h4-7,12-13,17,19H,8-11H2,1-3H3
InChIKeyOAXUFRIKZCYPIV-UHFFFAOYSA-N
MW283.42 g/mol
LogP3.49
Rot. Bonds4

About 2,2-dimethyl-N-[2-(4-methylpyrazol-1-yl)ethyl]-3,4-dihydro-1H-naphthalen-1-amine

2,2-dimethyl-N-[2-(4-methylpyrazol-1-yl)ethyl]-3,4-dihydro-1H-naphthalen-1-amine (PubChem CID 104577694) has the molecular formula C18H25N3 and a molecular weight of 283.42 g/mol. Its IUPAC name is 2,2-dimethyl-N-[2-(4-methylpyrazol-1-yl)ethyl]-3,4-dihydro-1H-naphthalen-1-amine.

Molecular Properties

Compound Name2,2-dimethyl-N-[2-(4-methylpyrazol-1-yl)ethyl]-3,4-dihydro-1H-naphthalen-1-amine
PubChem CID104577694
Molecular FormulaC18H25N3
Molecular Weight283.42 g/mol
Exact Mass283.20
IUPAC Name2,2-dimethyl-N-[2-(4-methylpyrazol-1-yl)ethyl]-3,4-dihydro-1H-naphthalen-1-amine
SMILESCc1cnn(CCNC2c3ccccc3CCC2(C)C)c1
InChIInChI=1S/C18H25N3/c1-14-12-20-21(13-14)11-10-19-17-16-7-5-4-6-15(16)8-9-18(17,2)3/h4-7,12-13,17,19H,8-11H2,1-3H3
InChIKeyOAXUFRIKZCYPIV-UHFFFAOYSA-N
XLogP3.49
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.42
LogP ≤ 53.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2,2-dimethyl-N-(2-morpholin-4-ylethyl)-3,4-dihydro-1H-naphthalen-1-amine
CID 115531836
3-[(2,2-dimethyl-3,4-dihydro-1H-naphthalen-1-yl)amino]propan-1-ol
CID 113329785
2,2-dimethyl-N-[(6-methyl-3-pyridinyl)methyl]-3,4-dihydro-1H-naphthalen-1-amine
CID 115532070
6-methyl-N-[2-(4-methylpyrazol-1-yl)ethyl]-2,3-dihydro-1H-inden-1-amine
CID 103872004
4-[(2,2-dimethyl-3,4-dihydro-1H-naphthalen-1-yl)amino]butan-2-ol
CID 113329803
5-[(2,2-dimethyl-3,4-dihydro-1H-naphthalen-1-yl)amino]pentan-1-ol
CID 104577689
2,2-dimethyl-N-[(1-methylpyrazol-3-yl)methyl]-3,4-dihydro-1H-naphthalen-1-amine
CID 115491538
2,2-dimethyl-N-(2,2,2-trifluoroethyl)-3,4-dihydro-1H-naphthalen-1-amine
CID 113329778
(2R)-1-[(2,2-dimethyl-3,4-dihydro-1H-naphthalen-1-yl)amino]propan-2-ol
CID 114266891
2,2-dimethyl-N-[(4-methylmorpholin-2-yl)methyl]-3,4-dihydro-1H-naphthalen-1-amine
CID 115532154
3-[2-(4-methylpyrazol-1-yl)ethylamino]-1-phenylcyclobutane-1-carbonitrile
CID 102612942
N-methyl-2-[2-(4-methylpyrazol-1-yl)ethylamino]-N-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]acetamide
CID 95750345

Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-N-[2-(4-methylpyrazol-1-yl)ethyl]-3,4-dihydro-1H-naphthalen-1-amine?
The IUPAC name of 2,2-dimethyl-N-[2-(4-methylpyrazol-1-yl)ethyl]-3,4-dihydro-1H-naphthalen-1-amine (CID 104577694) is 2,2-dimethyl-N-[2-(4-methylpyrazol-1-yl)ethyl]-3,4-dihydro-1H-naphthalen-1-amine.
What is the SMILES notation for 2,2-dimethyl-N-[2-(4-methylpyrazol-1-yl)ethyl]-3,4-dihydro-1H-naphthalen-1-amine?
The canonical SMILES for 2,2-dimethyl-N-[2-(4-methylpyrazol-1-yl)ethyl]-3,4-dihydro-1H-naphthalen-1-amine is Cc1cnn(CCNC2c3ccccc3CCC2(C)C)c1.
What is the InChIKey of 2,2-dimethyl-N-[2-(4-methylpyrazol-1-yl)ethyl]-3,4-dihydro-1H-naphthalen-1-amine?
The InChIKey is OAXUFRIKZCYPIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25N3/c1-14-12-20-21(13-14)11-10-19-17-16-7-5-4-6-15(16)8-9-18(17,2)3/h4-7,12-13,17,19H,8-11H2,1-3H3.
What are the key properties of 2,2-dimethyl-N-[2-(4-methylpyrazol-1-yl)ethyl]-3,4-dihydro-1H-naphthalen-1-amine?
2,2-dimethyl-N-[2-(4-methylpyrazol-1-yl)ethyl]-3,4-dihydro-1H-naphthalen-1-amine has a molecular weight of 283.42 g/mol, XLogP of 3.49, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-N-[2-(4-methylpyrazol-1-yl)ethyl]-3,4-dihydro-1H-naphthalen-1-amine is sourced from PubChem (CID 104577694), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).