2,2,3,3-tetramethyl-N-[(1-methyl-3,4-dihydro-2H-quinolin-6-yl)methyl]cyclopropan-1-amine

C18H28N2 — CID 79351945

IUPAC2,2,3,3-tetramethyl-N-[(1-methyl-3,4-dihydro-2H-quinolin-6-yl)methyl]cyclopropan-1-amine
SMILESCN1CCCc2cc(CNC3C(C)(C)C3(C)C)ccc21
InChIInChI=1S/C18H28N2/c1-17(2)16(18(17,3)4)19-12-13-8-9-15-14(11-13)7-6-10-20(15)5/h8-9,11,16,19H,6-7,10,12H2,1-5H3
InChIKeyHBURIGVCFHUIPX-UHFFFAOYSA-N
MW272.44 g/mol
LogP3.59
Rot. Bonds3

About 2,2,3,3-tetramethyl-N-[(1-methyl-3,4-dihydro-2H-quinolin-6-yl)methyl]cyclopropan-1-amine

2,2,3,3-tetramethyl-N-[(1-methyl-3,4-dihydro-2H-quinolin-6-yl)methyl]cyclopropan-1-amine (PubChem CID 79351945) has the molecular formula C18H28N2 and a molecular weight of 272.44 g/mol. Its IUPAC name is 2,2,3,3-tetramethyl-N-[(1-methyl-3,4-dihydro-2H-quinolin-6-yl)methyl]cyclopropan-1-amine.

Molecular Properties

Compound Name2,2,3,3-tetramethyl-N-[(1-methyl-3,4-dihydro-2H-quinolin-6-yl)methyl]cyclopropan-1-amine
PubChem CID79351945
Molecular FormulaC18H28N2
Molecular Weight272.44 g/mol
Exact Mass272.23
IUPAC Name2,2,3,3-tetramethyl-N-[(1-methyl-3,4-dihydro-2H-quinolin-6-yl)methyl]cyclopropan-1-amine
SMILESCN1CCCc2cc(CNC3C(C)(C)C3(C)C)ccc21
InChIInChI=1S/C18H28N2/c1-17(2)16(18(17,3)4)19-12-13-8-9-15-14(11-13)7-6-10-20(15)5/h8-9,11,16,19H,6-7,10,12H2,1-5H3
InChIKeyHBURIGVCFHUIPX-UHFFFAOYSA-N
XLogP3.59
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.44
LogP ≤ 53.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_D(198)', 'substructure': 'N/A'}

Analyze 2,2,3,3-tetramethyl-N-[(1-methyl-3,4-dihydro-2H-quinolin-6-yl)methyl]cyclopropan-1-amine with MolForge

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Related Compounds

2-methyl-N-[(1-methyl-3,4-dihydro-2H-quinolin-6-yl)methyl]cyclohexan-1-amine
CID 25219747
1-methyl-N-[(1-methyl-3,4-dihydro-2H-quinolin-6-yl)methyl]cyclohexan-1-amine
CID 62096877
N-[(1-methyl-3,4-dihydro-2H-quinolin-6-yl)methyl]-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-amine
CID 62096160
2-methyl-N-[(1-methyl-3,4-dihydro-2H-quinolin-6-yl)methyl]oxolan-3-amine
CID 115337256
3-methyl-N-[(1-methyl-3,4-dihydro-2H-quinolin-6-yl)methyl]cyclopentan-1-amine
CID 115653008
4-ethyl-N-[(1-methyl-3,4-dihydro-2H-quinolin-6-yl)methyl]cyclohexan-1-amine
CID 63453890
2-[(1-methyl-3,4-dihydro-2H-quinolin-6-yl)methylamino]cyclopentane-1-carbonitrile
CID 62963122
3-ethyl-2-methyl-N-[(1-methyl-3,4-dihydro-2H-quinolin-6-yl)methyl]cyclopentan-1-amine
CID 64922906
4-ethyl-N-[(1-methyl-3,4-dihydro-2H-quinolin-6-yl)methyl]aniline
CID 62097544
N-[(1-methyl-3,4-dihydro-2H-quinolin-6-yl)methyl]prop-2-en-1-amine
CID 62072231
1-(2,2-dimethyl-1,3-dioxolan-4-yl)-N-[(1-methyl-3,4-dihydro-2H-quinolin-6-yl)methyl]methanamine
CID 107386248
4-[(1-methyl-3,4-dihydro-2H-quinolin-6-yl)methylamino]phenol
CID 62094965

Frequently Asked Questions

What is the IUPAC name of 2,2,3,3-tetramethyl-N-[(1-methyl-3,4-dihydro-2H-quinolin-6-yl)methyl]cyclopropan-1-amine?
The IUPAC name of 2,2,3,3-tetramethyl-N-[(1-methyl-3,4-dihydro-2H-quinolin-6-yl)methyl]cyclopropan-1-amine (CID 79351945) is 2,2,3,3-tetramethyl-N-[(1-methyl-3,4-dihydro-2H-quinolin-6-yl)methyl]cyclopropan-1-amine.
What is the SMILES notation for 2,2,3,3-tetramethyl-N-[(1-methyl-3,4-dihydro-2H-quinolin-6-yl)methyl]cyclopropan-1-amine?
The canonical SMILES for 2,2,3,3-tetramethyl-N-[(1-methyl-3,4-dihydro-2H-quinolin-6-yl)methyl]cyclopropan-1-amine is CN1CCCc2cc(CNC3C(C)(C)C3(C)C)ccc21.
What is the InChIKey of 2,2,3,3-tetramethyl-N-[(1-methyl-3,4-dihydro-2H-quinolin-6-yl)methyl]cyclopropan-1-amine?
The InChIKey is HBURIGVCFHUIPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H28N2/c1-17(2)16(18(17,3)4)19-12-13-8-9-15-14(11-13)7-6-10-20(15)5/h8-9,11,16,19H,6-7,10,12H2,1-5H3.
What are the key properties of 2,2,3,3-tetramethyl-N-[(1-methyl-3,4-dihydro-2H-quinolin-6-yl)methyl]cyclopropan-1-amine?
2,2,3,3-tetramethyl-N-[(1-methyl-3,4-dihydro-2H-quinolin-6-yl)methyl]cyclopropan-1-amine has a molecular weight of 272.44 g/mol, XLogP of 3.59, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,3,3-tetramethyl-N-[(1-methyl-3,4-dihydro-2H-quinolin-6-yl)methyl]cyclopropan-1-amine is sourced from PubChem (CID 79351945), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).