(1S)-1-(5,6,7,8-tetrahydronaphthalen-1-yl)propan-1-amine

C13H19N — CID 130644887

IUPAC(1S)-1-(5,6,7,8-tetrahydronaphthalen-1-yl)propan-1-amine
SMILESCC[C@H](N)c1cccc2c1CCCC2
InChIInChI=1S/C13H19N/c1-2-13(14)12-9-5-7-10-6-3-4-8-11(10)12/h5,7,9,13H,2-4,6,8,14H2,1H3/t13-/m0/s1
InChIKeyAPSVOULVPIYYRU-ZDUSSCGKSA-N
MW189.30 g/mol
LogP2.98
Rot. Bonds2

About (1S)-1-(5,6,7,8-tetrahydronaphthalen-1-yl)propan-1-amine

(1S)-1-(5,6,7,8-tetrahydronaphthalen-1-yl)propan-1-amine (PubChem CID 130644887) has the molecular formula C13H19N and a molecular weight of 189.30 g/mol. Its IUPAC name is (1S)-1-(5,6,7,8-tetrahydronaphthalen-1-yl)propan-1-amine.

Molecular Properties

Compound Name(1S)-1-(5,6,7,8-tetrahydronaphthalen-1-yl)propan-1-amine
PubChem CID130644887
Molecular FormulaC13H19N
Molecular Weight189.30 g/mol
Exact Mass189.15
IUPAC Name(1S)-1-(5,6,7,8-tetrahydronaphthalen-1-yl)propan-1-amine
SMILESCC[C@H](N)c1cccc2c1CCCC2
InChIInChI=1S/C13H19N/c1-2-13(14)12-9-5-7-10-6-3-4-8-11(10)12/h5,7,9,13H,2-4,6,8,14H2,1H3/t13-/m0/s1
InChIKeyAPSVOULVPIYYRU-ZDUSSCGKSA-N
XLogP2.98
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.30
LogP ≤ 52.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

5-(difluoromethyl)-1,2,3,4-tetrahydronaphthalene
CID 159912774
(1R)-1-(7-methyl-2,3-dihydro-1H-inden-4-yl)propan-1-amine
CID 130655075
5-ethyl-2,3-dihydro-1H-indene;4-propan-2-yl-2,3-dihydro-1H-indene
CID 178128583
(2R)-2-amino-2-(2,3-dihydro-1H-inden-4-yl)acetic acid
CID 130783768
1-(2-iodo-3-methylphenyl)propan-1-amine
CID 103846034
1-(3-fluoro-5,6,7,8-tetrahydronaphthalen-2-yl)propan-1-amine
CID 83988283
1-(2-ethyl-3-methylphenyl)propan-1-amine
CID 55283477
1-(2,6-dimethylphenyl)propan-1-amine
CID 55282920
N,N-diethyl-5,6,7,8-tetrahydronaphthalen-1-amine
CID 71344847
5-ethyl-1,2,3,4-tetrahydronaphthalene;1-propan-2-ylnaphthalene
CID 166553359
2-(1-aminopropyl)benzenethiol
CID 22286714
2-[(1S)-1-aminopropyl]benzenethiol
CID 55292723

Frequently Asked Questions

What is the IUPAC name of (1S)-1-(5,6,7,8-tetrahydronaphthalen-1-yl)propan-1-amine?
The IUPAC name of (1S)-1-(5,6,7,8-tetrahydronaphthalen-1-yl)propan-1-amine (CID 130644887) is (1S)-1-(5,6,7,8-tetrahydronaphthalen-1-yl)propan-1-amine.
What is the SMILES notation for (1S)-1-(5,6,7,8-tetrahydronaphthalen-1-yl)propan-1-amine?
The canonical SMILES for (1S)-1-(5,6,7,8-tetrahydronaphthalen-1-yl)propan-1-amine is CC[C@H](N)c1cccc2c1CCCC2.
What is the InChIKey of (1S)-1-(5,6,7,8-tetrahydronaphthalen-1-yl)propan-1-amine?
The InChIKey is APSVOULVPIYYRU-ZDUSSCGKSA-N. The full InChI is InChI=1S/C13H19N/c1-2-13(14)12-9-5-7-10-6-3-4-8-11(10)12/h5,7,9,13H,2-4,6,8,14H2,1H3/t13-/m0/s1.
What are the key properties of (1S)-1-(5,6,7,8-tetrahydronaphthalen-1-yl)propan-1-amine?
(1S)-1-(5,6,7,8-tetrahydronaphthalen-1-yl)propan-1-amine has a molecular weight of 189.30 g/mol, XLogP of 2.98, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1S)-1-(5,6,7,8-tetrahydronaphthalen-1-yl)propan-1-amine is sourced from PubChem (CID 130644887), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).