2-[4-(1-amino-2-methylpropan-2-yl)phenyl]-2-methylpropan-1-amine;hydrochloride

C14H25ClN2 — CID 74889721

IUPAC2-[4-(1-amino-2-methylpropan-2-yl)phenyl]-2-methylpropan-1-amine;hydrochloride
SMILESCC(C)(CN)c1ccc(C(C)(C)CN)cc1.Cl
InChIInChI=1S/C14H24N2.ClH/c1-13(2,9-15)11-5-7-12(8-6-11)14(3,4)10-16;/h5-8H,9-10,15-16H2,1-4H3;1H
InChIKeyGZNBQSLSGZYCSS-UHFFFAOYSA-N
MW256.82 g/mol
LogP2.58
Rot. Bonds4

About 2-[4-(1-amino-2-methylpropan-2-yl)phenyl]-2-methylpropan-1-amine;hydrochloride

2-[4-(1-amino-2-methylpropan-2-yl)phenyl]-2-methylpropan-1-amine;hydrochloride (PubChem CID 74889721) has the molecular formula C14H25ClN2 and a molecular weight of 256.82 g/mol. Its IUPAC name is 2-[4-(1-amino-2-methylpropan-2-yl)phenyl]-2-methylpropan-1-amine;hydrochloride.

Molecular Properties

Compound Name2-[4-(1-amino-2-methylpropan-2-yl)phenyl]-2-methylpropan-1-amine;hydrochloride
PubChem CID74889721
Molecular FormulaC14H25ClN2
Molecular Weight256.82 g/mol
Exact Mass256.17
IUPAC Name2-[4-(1-amino-2-methylpropan-2-yl)phenyl]-2-methylpropan-1-amine;hydrochloride
SMILESCC(C)(CN)c1ccc(C(C)(C)CN)cc1.Cl
InChIInChI=1S/C14H24N2.ClH/c1-13(2,9-15)11-5-7-12(8-6-11)14(3,4)10-16;/h5-8H,9-10,15-16H2,1-4H3;1H
InChIKeyGZNBQSLSGZYCSS-UHFFFAOYSA-N
XLogP2.58
TPSA52.04 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.82
LogP ≤ 52.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-methyl-2-(4-methylphenyl)propan-1-amine;propane
CID 143028408
2-methyl-2-(4-phenylphenyl)propan-1-amine
CID 56687090
2-[4-(4-chlorophenyl)phenyl]-2-methylpropan-1-amine
CID 82090050
2-(4-butan-2-ylphenyl)-2-methylpropan-1-amine
CID 82077217
2-(4-ethylsulfonylphenyl)-2-methylpropan-1-amine
CID 82477614
2-[3-(1-amino-2-methylpropan-2-yl)phenyl]-2-methylpropan-1-amine
CID 57243357
2-[4-(3,5-difluorophenyl)phenyl]-2-methylpropan-1-amine
CID 82090474
2-(3,4-dichlorophenyl)-2-methylpropan-1-amine
CID 13290303
2-[4-(azepan-1-yl)phenyl]-2-methylpropan-1-amine
CID 28807053
2-[4-(3,3-dimethylazetidin-1-yl)phenyl]-2-methylpropan-1-amine
CID 79687839
2-[4-(3-fluorophenyl)phenyl]-2-methylpropan-1-amine
CID 82085168
2-(3-fluoro-4-iodophenyl)-2-methylpropan-1-amine
CID 117046684

Frequently Asked Questions

What is the IUPAC name of 2-[4-(1-amino-2-methylpropan-2-yl)phenyl]-2-methylpropan-1-amine;hydrochloride?
The IUPAC name of 2-[4-(1-amino-2-methylpropan-2-yl)phenyl]-2-methylpropan-1-amine;hydrochloride (CID 74889721) is 2-[4-(1-amino-2-methylpropan-2-yl)phenyl]-2-methylpropan-1-amine;hydrochloride.
What is the SMILES notation for 2-[4-(1-amino-2-methylpropan-2-yl)phenyl]-2-methylpropan-1-amine;hydrochloride?
The canonical SMILES for 2-[4-(1-amino-2-methylpropan-2-yl)phenyl]-2-methylpropan-1-amine;hydrochloride is CC(C)(CN)c1ccc(C(C)(C)CN)cc1.Cl.
What is the InChIKey of 2-[4-(1-amino-2-methylpropan-2-yl)phenyl]-2-methylpropan-1-amine;hydrochloride?
The InChIKey is GZNBQSLSGZYCSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2.ClH/c1-13(2,9-15)11-5-7-12(8-6-11)14(3,4)10-16;/h5-8H,9-10,15-16H2,1-4H3;1H.
What are the key properties of 2-[4-(1-amino-2-methylpropan-2-yl)phenyl]-2-methylpropan-1-amine;hydrochloride?
2-[4-(1-amino-2-methylpropan-2-yl)phenyl]-2-methylpropan-1-amine;hydrochloride has a molecular weight of 256.82 g/mol, XLogP of 2.58, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(1-amino-2-methylpropan-2-yl)phenyl]-2-methylpropan-1-amine;hydrochloride is sourced from PubChem (CID 74889721), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).