N-cyclopropyl-1,2,3,4-tetrahydroquinolin-4-amine

C12H16N2 — CID 105443290

IUPACN-cyclopropyl-1,2,3,4-tetrahydroquinolin-4-amine
SMILESc1ccc2c(c1)NCCC2NC1CC1
InChIInChI=1S/C12H16N2/c1-2-4-11-10(3-1)12(7-8-13-11)14-9-5-6-9/h1-4,9,12-14H,5-8H2
InChIKeyIDVYERRJDRJSDC-UHFFFAOYSA-N
MW188.27 g/mol
LogP2.30
Rot. Bonds2

About N-cyclopropyl-1,2,3,4-tetrahydroquinolin-4-amine

N-cyclopropyl-1,2,3,4-tetrahydroquinolin-4-amine (PubChem CID 105443290) has the molecular formula C12H16N2 and a molecular weight of 188.27 g/mol. Its IUPAC name is N-cyclopropyl-1,2,3,4-tetrahydroquinolin-4-amine.

Molecular Properties

Compound NameN-cyclopropyl-1,2,3,4-tetrahydroquinolin-4-amine
PubChem CID105443290
Molecular FormulaC12H16N2
Molecular Weight188.27 g/mol
Exact Mass188.13
IUPAC NameN-cyclopropyl-1,2,3,4-tetrahydroquinolin-4-amine
SMILESc1ccc2c(c1)NCCC2NC1CC1
InChIInChI=1S/C12H16N2/c1-2-4-11-10(3-1)12(7-8-13-11)14-9-5-6-9/h1-4,9,12-14H,5-8H2
InChIKeyIDVYERRJDRJSDC-UHFFFAOYSA-N
XLogP2.30
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.27
LogP ≤ 52.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-1,2,3,4-tetrahydroquinolin-4-amine?
The IUPAC name of N-cyclopropyl-1,2,3,4-tetrahydroquinolin-4-amine (CID 105443290) is N-cyclopropyl-1,2,3,4-tetrahydroquinolin-4-amine.
What is the SMILES notation for N-cyclopropyl-1,2,3,4-tetrahydroquinolin-4-amine?
The canonical SMILES for N-cyclopropyl-1,2,3,4-tetrahydroquinolin-4-amine is c1ccc2c(c1)NCCC2NC1CC1.
What is the InChIKey of N-cyclopropyl-1,2,3,4-tetrahydroquinolin-4-amine?
The InChIKey is IDVYERRJDRJSDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N2/c1-2-4-11-10(3-1)12(7-8-13-11)14-9-5-6-9/h1-4,9,12-14H,5-8H2.
What are the key properties of N-cyclopropyl-1,2,3,4-tetrahydroquinolin-4-amine?
N-cyclopropyl-1,2,3,4-tetrahydroquinolin-4-amine has a molecular weight of 188.27 g/mol, XLogP of 2.30, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-1,2,3,4-tetrahydroquinolin-4-amine is sourced from PubChem (CID 105443290), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).