(2R)-N-methyl-4-(2-methyltetrazol-5-yl)-4,4-diphenylbutan-2-amine

C19H23N5 — CID 125485908

IUPAC(2R)-N-methyl-4-(2-methyltetrazol-5-yl)-4,4-diphenylbutan-2-amine
SMILESCN[C@H](C)CC(c1ccccc1)(c1ccccc1)c1nnn(C)n1
InChIInChI=1S/C19H23N5/c1-15(20-2)14-19(16-10-6-4-7-11-16,17-12-8-5-9-13-17)18-21-23-24(3)22-18/h4-13,15,20H,14H2,1-3H3/t15-/m1/s1
InChIKeyPNLQEDRNYUIQRS-OAHLLOKOSA-N
MW321.43 g/mol
LogP2.54
Rot. Bonds6

About (2R)-N-methyl-4-(2-methyltetrazol-5-yl)-4,4-diphenylbutan-2-amine

(2R)-N-methyl-4-(2-methyltetrazol-5-yl)-4,4-diphenylbutan-2-amine (PubChem CID 125485908) has the molecular formula C19H23N5 and a molecular weight of 321.43 g/mol. Its IUPAC name is (2R)-N-methyl-4-(2-methyltetrazol-5-yl)-4,4-diphenylbutan-2-amine.

Molecular Properties

Compound Name(2R)-N-methyl-4-(2-methyltetrazol-5-yl)-4,4-diphenylbutan-2-amine
PubChem CID125485908
Molecular FormulaC19H23N5
Molecular Weight321.43 g/mol
Exact Mass321.20
IUPAC Name(2R)-N-methyl-4-(2-methyltetrazol-5-yl)-4,4-diphenylbutan-2-amine
SMILESCN[C@H](C)CC(c1ccccc1)(c1ccccc1)c1nnn(C)n1
InChIInChI=1S/C19H23N5/c1-15(20-2)14-19(16-10-6-4-7-11-16,17-12-8-5-9-13-17)18-21-23-24(3)22-18/h4-13,15,20H,14H2,1-3H3/t15-/m1/s1
InChIKeyPNLQEDRNYUIQRS-OAHLLOKOSA-N
XLogP2.54
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.43
LogP ≤ 52.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

(3R)-3-(methylamino)-1,1-diphenylbutan-1-ol
CID 129362138
3-ethyl-N-methyl-1-(2-methyltetrazol-5-yl)-3-phenylpentan-2-amine
CID 107049144
(2R)-N,4-dimethyl-4-phenylpentan-2-amine
CID 42077724
(6R)-6-(methylamino)-4,4-diphenylheptan-3-one
CID 131842164
1-(2-methyltetrazol-5-yl)-4-phenyl-N-propylbutan-2-amine
CID 107048747
N-methyl-1-(2-methyltetrazol-5-yl)-3-phenylsulfanylpropan-2-amine
CID 107049422
N-methyl-2-(2-methyltetrazol-5-yl)-1-[3-(trifluoromethyl)phenyl]ethanamine
CID 107048370
2-chloro-N-[(2-methyltetrazol-5-yl)methyl]-2-phenylethanamine
CID 107054007
3-(2-methyltetrazol-5-yl)-2-phenyl-N-propylpropan-1-amine
CID 107053280
N,2-dimethyl-4-(2-methyltetrazol-5-yl)butan-1-amine
CID 107054920
2,3,5-trimethylhexan-3-ylbenzene
CID 123149580
(1R)-N-[(2-methyltetrazol-5-yl)methyl]-1-pyridin-2-ylethanamine
CID 107042590

Frequently Asked Questions

What is the IUPAC name of (2R)-N-methyl-4-(2-methyltetrazol-5-yl)-4,4-diphenylbutan-2-amine?
The IUPAC name of (2R)-N-methyl-4-(2-methyltetrazol-5-yl)-4,4-diphenylbutan-2-amine (CID 125485908) is (2R)-N-methyl-4-(2-methyltetrazol-5-yl)-4,4-diphenylbutan-2-amine.
What is the SMILES notation for (2R)-N-methyl-4-(2-methyltetrazol-5-yl)-4,4-diphenylbutan-2-amine?
The canonical SMILES for (2R)-N-methyl-4-(2-methyltetrazol-5-yl)-4,4-diphenylbutan-2-amine is CN[C@H](C)CC(c1ccccc1)(c1ccccc1)c1nnn(C)n1.
What is the InChIKey of (2R)-N-methyl-4-(2-methyltetrazol-5-yl)-4,4-diphenylbutan-2-amine?
The InChIKey is PNLQEDRNYUIQRS-OAHLLOKOSA-N. The full InChI is InChI=1S/C19H23N5/c1-15(20-2)14-19(16-10-6-4-7-11-16,17-12-8-5-9-13-17)18-21-23-24(3)22-18/h4-13,15,20H,14H2,1-3H3/t15-/m1/s1.
What are the key properties of (2R)-N-methyl-4-(2-methyltetrazol-5-yl)-4,4-diphenylbutan-2-amine?
(2R)-N-methyl-4-(2-methyltetrazol-5-yl)-4,4-diphenylbutan-2-amine has a molecular weight of 321.43 g/mol, XLogP of 2.54, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-methyl-4-(2-methyltetrazol-5-yl)-4,4-diphenylbutan-2-amine is sourced from PubChem (CID 125485908), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).