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

C13H18N2 — CID 105454816

IUPACN-cyclobutyl-1,2,3,4-tetrahydroquinolin-3-amine
SMILESc1ccc2c(c1)CC(NC1CCC1)CN2
InChIInChI=1S/C13H18N2/c1-2-7-13-10(4-1)8-12(9-14-13)15-11-5-3-6-11/h1-2,4,7,11-12,14-15H,3,5-6,8-9H2
InChIKeyKUYOPQWZMGKVHB-UHFFFAOYSA-N
MW202.30 g/mol
LogP2.17
Rot. Bonds2

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

N-cyclobutyl-1,2,3,4-tetrahydroquinolin-3-amine (PubChem CID 105454816) has the molecular formula C13H18N2 and a molecular weight of 202.30 g/mol. Its IUPAC name is N-cyclobutyl-1,2,3,4-tetrahydroquinolin-3-amine.

Molecular Properties

Compound NameN-cyclobutyl-1,2,3,4-tetrahydroquinolin-3-amine
PubChem CID105454816
Molecular FormulaC13H18N2
Molecular Weight202.30 g/mol
Exact Mass202.15
IUPAC NameN-cyclobutyl-1,2,3,4-tetrahydroquinolin-3-amine
SMILESc1ccc2c(c1)CC(NC1CCC1)CN2
InChIInChI=1S/C13H18N2/c1-2-7-13-10(4-1)8-12(9-14-13)15-11-5-3-6-11/h1-2,4,7,11-12,14-15H,3,5-6,8-9H2
InChIKeyKUYOPQWZMGKVHB-UHFFFAOYSA-N
XLogP2.17
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.30
LogP ≤ 52.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(oxan-4-yl)-1,2,3,4-tetrahydroquinolin-3-amine
CID 105491661
(3S)-N-methyl-1,2,3,4-tetrahydroquinolin-3-amine
CID 96558902
N-cyclobutyl-6-fluoro-1,2,3,4-tetrahydroquinolin-3-amine
CID 105476077
N-(1,2,3,4-tetrahydroquinolin-3-yl)benzenesulfonamide
CID 18177121
2,2,2-trifluoro-N-(1,2,3,4-tetrahydroquinolin-3-yl)acetamide
CID 130638230
1,2,3,4,5,6-hexahydro-1-benzazocin-3-ylcarbamic acid
CID 155145512
N-cycloheptyl-N-methyl-1,2,3,4-tetrahydroquinolin-3-amine
CID 54861284
2-methyl-N-(1,2,3,4-tetrahydroquinolin-3-yl)piperidine-1-sulfonamide
CID 43109899
ethyl N-(1,2,3,4-tetrahydroquinolin-3-yl)carbamate
CID 19697803
N-cyclopentyl-2-(1,2,3,4-tetrahydroquinolin-3-yloxy)acetamide
CID 107387448
N-(1,2,3,4-tetrahydroquinolin-3-yl)-2,3-dihydro-1H-indene-5-carboxamide
CID 43823005
1,1-dioxo-N-(1,2,3,4-tetrahydroquinolin-3-yl)thiolane-3-carboxamide
CID 64911727

Frequently Asked Questions

What is the IUPAC name of N-cyclobutyl-1,2,3,4-tetrahydroquinolin-3-amine?
The IUPAC name of N-cyclobutyl-1,2,3,4-tetrahydroquinolin-3-amine (CID 105454816) is N-cyclobutyl-1,2,3,4-tetrahydroquinolin-3-amine.
What is the SMILES notation for N-cyclobutyl-1,2,3,4-tetrahydroquinolin-3-amine?
The canonical SMILES for N-cyclobutyl-1,2,3,4-tetrahydroquinolin-3-amine is c1ccc2c(c1)CC(NC1CCC1)CN2.
What is the InChIKey of N-cyclobutyl-1,2,3,4-tetrahydroquinolin-3-amine?
The InChIKey is KUYOPQWZMGKVHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2/c1-2-7-13-10(4-1)8-12(9-14-13)15-11-5-3-6-11/h1-2,4,7,11-12,14-15H,3,5-6,8-9H2.
What are the key properties of N-cyclobutyl-1,2,3,4-tetrahydroquinolin-3-amine?
N-cyclobutyl-1,2,3,4-tetrahydroquinolin-3-amine has a molecular weight of 202.30 g/mol, XLogP of 2.17, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclobutyl-1,2,3,4-tetrahydroquinolin-3-amine is sourced from PubChem (CID 105454816), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).