1-phenyl-N-[(1R)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethyl]tetrazol-5-amine

C19H21N5 — CID 9030099

IUPAC1-phenyl-N-[(1R)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethyl]tetrazol-5-amine
SMILESC[C@@H](Nc1nnnn1-c1ccccc1)c1ccc2c(c1)CCCC2
InChIInChI=1S/C19H21N5/c1-14(16-12-11-15-7-5-6-8-17(15)13-16)20-19-21-22-23-24(19)18-9-3-2-4-10-18/h2-4,9-14H,5-8H2,1H3,(H,20,21,23)/t14-/m1/s1
InChIKeyXGURLGIYLDPETK-CQSZACIVSA-N
MW319.41 g/mol
LogP3.71
Rot. Bonds4

About 1-phenyl-N-[(1R)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethyl]tetrazol-5-amine

1-phenyl-N-[(1R)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethyl]tetrazol-5-amine (PubChem CID 9030099) has the molecular formula C19H21N5 and a molecular weight of 319.41 g/mol. Its IUPAC name is 1-phenyl-N-[(1R)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethyl]tetrazol-5-amine.

Molecular Properties

Compound Name1-phenyl-N-[(1R)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethyl]tetrazol-5-amine
PubChem CID9030099
Molecular FormulaC19H21N5
Molecular Weight319.41 g/mol
Exact Mass319.18
IUPAC Name1-phenyl-N-[(1R)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethyl]tetrazol-5-amine
SMILESC[C@@H](Nc1nnnn1-c1ccccc1)c1ccc2c(c1)CCCC2
InChIInChI=1S/C19H21N5/c1-14(16-12-11-15-7-5-6-8-17(15)13-16)20-19-21-22-23-24(19)18-9-3-2-4-10-18/h2-4,9-14H,5-8H2,1H3,(H,20,21,23)/t14-/m1/s1
InChIKeyXGURLGIYLDPETK-CQSZACIVSA-N
XLogP3.71
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.41
LogP ≤ 53.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[1-(3-bromophenyl)ethyl]-1-phenyltetrazol-5-amine
CID 60746209
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CID 9195049
N-[1-(3-chlorophenyl)ethyl]-1-phenyltetrazol-5-amine
CID 42909642
N-[1-(2-methylphenyl)ethyl]-1-phenyltetrazol-5-amine
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1-phenyl-N-[1-(1H-1,2,4-triazol-5-yl)ethyl]tetrazol-5-amine
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3-propan-2-yl-6-[[(1S)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethyl]amino]-1H-pyrimidine-2,4-dione
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2-methoxy-N-[1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethyl]aniline
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N-[(1S)-1-(2,3-dihydro-1H-inden-5-yl)ethyl]-1-propan-2-yl-2H-1,3,5-triazin-4-amine
CID 175727632
1-phenyl-N-[2-(4-propan-2-ylphenyl)ethyl]tetrazol-5-amine
CID 9107188
1-propan-2-yl-N-[(1S)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethyl]-2H-pyrimidin-4-amine
CID 175742427
N-[(1S)-1-pyridin-3-ylethyl]-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanamine
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Frequently Asked Questions

What is the IUPAC name of 1-phenyl-N-[(1R)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethyl]tetrazol-5-amine?
The IUPAC name of 1-phenyl-N-[(1R)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethyl]tetrazol-5-amine (CID 9030099) is 1-phenyl-N-[(1R)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethyl]tetrazol-5-amine.
What is the SMILES notation for 1-phenyl-N-[(1R)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethyl]tetrazol-5-amine?
The canonical SMILES for 1-phenyl-N-[(1R)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethyl]tetrazol-5-amine is C[C@@H](Nc1nnnn1-c1ccccc1)c1ccc2c(c1)CCCC2.
What is the InChIKey of 1-phenyl-N-[(1R)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethyl]tetrazol-5-amine?
The InChIKey is XGURLGIYLDPETK-CQSZACIVSA-N. The full InChI is InChI=1S/C19H21N5/c1-14(16-12-11-15-7-5-6-8-17(15)13-16)20-19-21-22-23-24(19)18-9-3-2-4-10-18/h2-4,9-14H,5-8H2,1H3,(H,20,21,23)/t14-/m1/s1.
What are the key properties of 1-phenyl-N-[(1R)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethyl]tetrazol-5-amine?
1-phenyl-N-[(1R)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethyl]tetrazol-5-amine has a molecular weight of 319.41 g/mol, XLogP of 3.71, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-phenyl-N-[(1R)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethyl]tetrazol-5-amine is sourced from PubChem (CID 9030099), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).