N-(2-methylprop-2-enyl)-5,6,7,8-tetrahydroquinolin-8-amine

C13H18N2 — CID 114615760

IUPACN-(2-methylprop-2-enyl)-5,6,7,8-tetrahydroquinolin-8-amine
SMILESC=C(C)CNC1CCCc2cccnc21
InChIInChI=1S/C13H18N2/c1-10(2)9-15-12-7-3-5-11-6-4-8-14-13(11)12/h4,6,8,12,15H,1,3,5,7,9H2,2H3
InChIKeySUFCWWGCVZBDPZ-UHFFFAOYSA-N
MW202.30 g/mol
LogP2.62
Rot. Bonds3

About N-(2-methylprop-2-enyl)-5,6,7,8-tetrahydroquinolin-8-amine

N-(2-methylprop-2-enyl)-5,6,7,8-tetrahydroquinolin-8-amine (PubChem CID 114615760) has the molecular formula C13H18N2 and a molecular weight of 202.30 g/mol. Its IUPAC name is N-(2-methylprop-2-enyl)-5,6,7,8-tetrahydroquinolin-8-amine.

Molecular Properties

Compound NameN-(2-methylprop-2-enyl)-5,6,7,8-tetrahydroquinolin-8-amine
PubChem CID114615760
Molecular FormulaC13H18N2
Molecular Weight202.30 g/mol
Exact Mass202.15
IUPAC NameN-(2-methylprop-2-enyl)-5,6,7,8-tetrahydroquinolin-8-amine
SMILESC=C(C)CNC1CCCc2cccnc21
InChIInChI=1S/C13H18N2/c1-10(2)9-15-12-7-3-5-11-6-4-8-14-13(11)12/h4,6,8,12,15H,1,3,5,7,9H2,2H3
InChIKeySUFCWWGCVZBDPZ-UHFFFAOYSA-N
XLogP2.62
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.30
LogP ≤ 52.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-methyl-1-(5,6,7,8-tetrahydroquinolin-8-ylamino)propan-2-ol
CID 79078513
N-prop-2-ynyl-5,6,7,8-tetrahydroquinolin-8-amine
CID 79079711
N-[[4-[(5,6,7,8-tetrahydroquinolin-8-ylamino)methyl]phenyl]methyl]-5,6,7,8-tetrahydroquinolin-8-amine
CID 71026047
(8S)-N-methyl-5,6,7,8-tetrahydroquinolin-8-amine
CID 58985331
N-(cyclopentylmethyl)-5,6,7,8-tetrahydroquinolin-8-amine
CID 79079348
5-(5,6,7,8-tetrahydroquinolin-8-ylamino)pentan-1-ol
CID 107316747
3-methyl-4-(5,6,7,8-tetrahydroquinolin-8-ylamino)butan-1-ol
CID 79080089
3,3-dimethyl-4-(5,6,7,8-tetrahydroquinolin-8-ylamino)butan-1-ol
CID 114149434
(8S)-N-benzyl-5,6,7,8-tetrahydroquinolin-8-amine
CID 11736560
N-[[5-[(5,6,7,8-tetrahydroquinolin-8-ylamino)methyl]pyrazin-2-yl]methyl]-5,6,7,8-tetrahydroquinolin-8-amine
CID 74539206
N-(2,2-dimethoxyethyl)-5,6,7,8-tetrahydroquinolin-8-amine
CID 79080071
1-cyclopropyl-2-(5,6,7,8-tetrahydroquinolin-8-ylamino)ethanol
CID 79079971

Frequently Asked Questions

What is the IUPAC name of N-(2-methylprop-2-enyl)-5,6,7,8-tetrahydroquinolin-8-amine?
The IUPAC name of N-(2-methylprop-2-enyl)-5,6,7,8-tetrahydroquinolin-8-amine (CID 114615760) is N-(2-methylprop-2-enyl)-5,6,7,8-tetrahydroquinolin-8-amine.
What is the SMILES notation for N-(2-methylprop-2-enyl)-5,6,7,8-tetrahydroquinolin-8-amine?
The canonical SMILES for N-(2-methylprop-2-enyl)-5,6,7,8-tetrahydroquinolin-8-amine is C=C(C)CNC1CCCc2cccnc21.
What is the InChIKey of N-(2-methylprop-2-enyl)-5,6,7,8-tetrahydroquinolin-8-amine?
The InChIKey is SUFCWWGCVZBDPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2/c1-10(2)9-15-12-7-3-5-11-6-4-8-14-13(11)12/h4,6,8,12,15H,1,3,5,7,9H2,2H3.
What are the key properties of N-(2-methylprop-2-enyl)-5,6,7,8-tetrahydroquinolin-8-amine?
N-(2-methylprop-2-enyl)-5,6,7,8-tetrahydroquinolin-8-amine has a molecular weight of 202.30 g/mol, XLogP of 2.62, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylprop-2-enyl)-5,6,7,8-tetrahydroquinolin-8-amine is sourced from PubChem (CID 114615760), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).