8-pyrrolidin-1-yl-5,6,7,8-tetrahydronaphthalen-2-amine

C14H20N2 — CID 105470466

IUPAC8-pyrrolidin-1-yl-5,6,7,8-tetrahydronaphthalen-2-amine
SMILESNc1ccc2c(c1)C(N1CCCC1)CCC2
InChIInChI=1S/C14H20N2/c15-12-7-6-11-4-3-5-14(13(11)10-12)16-8-1-2-9-16/h6-7,10,14H,1-5,8-9,15H2
InChIKeyPBBHDDSWAKWJOE-UHFFFAOYSA-N
MW216.33 g/mol
LogP2.74
Rot. Bonds1

About 8-pyrrolidin-1-yl-5,6,7,8-tetrahydronaphthalen-2-amine

8-pyrrolidin-1-yl-5,6,7,8-tetrahydronaphthalen-2-amine (PubChem CID 105470466) has the molecular formula C14H20N2 and a molecular weight of 216.33 g/mol. Its IUPAC name is 8-pyrrolidin-1-yl-5,6,7,8-tetrahydronaphthalen-2-amine.

Molecular Properties

Compound Name8-pyrrolidin-1-yl-5,6,7,8-tetrahydronaphthalen-2-amine
PubChem CID105470466
Molecular FormulaC14H20N2
Molecular Weight216.33 g/mol
Exact Mass216.16
IUPAC Name8-pyrrolidin-1-yl-5,6,7,8-tetrahydronaphthalen-2-amine
SMILESNc1ccc2c(c1)C(N1CCCC1)CCC2
InChIInChI=1S/C14H20N2/c15-12-7-6-11-4-3-5-14(13(11)10-12)16-8-1-2-9-16/h6-7,10,14H,1-5,8-9,15H2
InChIKeyPBBHDDSWAKWJOE-UHFFFAOYSA-N
XLogP2.74
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.33
LogP ≤ 52.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

(8R)-8-(4-methylpiperazin-1-yl)-5,6,7,8-tetrahydronaphthalen-2-amine
CID 129395359
5-piperidin-1-yl-5,6,7,8-tetrahydronaphthalen-2-amine
CID 116650618
3-(4-methylpiperazin-1-yl)-2,3-dihydro-1H-inden-5-amine
CID 105490242
8-piperidin-1-yl-5,6,7,8-tetrahydronaphthalen-2-ol
CID 86154069
1-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]pyrrolidine
CID 122364481
1-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]piperidine
CID 141000985
1,2,3,4-tetrahydronaphthalene-1,7-diamine
CID 21256693
(1R)-1,2,3,4-tetrahydronaphthalene-1,7-diamine
CID 55277801
7-amino-1,2,3,4-tetrahydronaphthalen-1-ol
CID 15840809
(8R)-8-methyl-5,6,7,8-tetrahydronaphthalen-2-amine
CID 57293578
8-(azetidin-1-ylmethyl)-5,6,7,8-tetrahydronaphthalen-2-amine
CID 105470439
[4-(6-amino-2,3-dihydro-1H-inden-1-yl)-2-methylpiperazin-1-yl]-cyclopentylmethanone
CID 123882865

Frequently Asked Questions

What is the IUPAC name of 8-pyrrolidin-1-yl-5,6,7,8-tetrahydronaphthalen-2-amine?
The IUPAC name of 8-pyrrolidin-1-yl-5,6,7,8-tetrahydronaphthalen-2-amine (CID 105470466) is 8-pyrrolidin-1-yl-5,6,7,8-tetrahydronaphthalen-2-amine.
What is the SMILES notation for 8-pyrrolidin-1-yl-5,6,7,8-tetrahydronaphthalen-2-amine?
The canonical SMILES for 8-pyrrolidin-1-yl-5,6,7,8-tetrahydronaphthalen-2-amine is Nc1ccc2c(c1)C(N1CCCC1)CCC2.
What is the InChIKey of 8-pyrrolidin-1-yl-5,6,7,8-tetrahydronaphthalen-2-amine?
The InChIKey is PBBHDDSWAKWJOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2/c15-12-7-6-11-4-3-5-14(13(11)10-12)16-8-1-2-9-16/h6-7,10,14H,1-5,8-9,15H2.
What are the key properties of 8-pyrrolidin-1-yl-5,6,7,8-tetrahydronaphthalen-2-amine?
8-pyrrolidin-1-yl-5,6,7,8-tetrahydronaphthalen-2-amine has a molecular weight of 216.33 g/mol, XLogP of 2.74, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-pyrrolidin-1-yl-5,6,7,8-tetrahydronaphthalen-2-amine is sourced from PubChem (CID 105470466), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).