N-tert-butyl-2-methylspiro[1,3-dihydroisoquinoline-4,1'-cyclopropane]-7-amine

C16H24N2 — CID 155362648

IUPACN-tert-butyl-2-methylspiro[1,3-dihydroisoquinoline-4,1'-cyclopropane]-7-amine
SMILESCN1Cc2cc(NC(C)(C)C)ccc2C2(CC2)C1
InChIInChI=1S/C16H24N2/c1-15(2,3)17-13-5-6-14-12(9-13)10-18(4)11-16(14)7-8-16/h5-6,9,17H,7-8,10-11H2,1-4H3
InChIKeyYRODLXDIHGAZIK-UHFFFAOYSA-N
MW244.38 g/mol
LogP3.37
Rot. Bonds1

About N-tert-butyl-2-methylspiro[1,3-dihydroisoquinoline-4,1'-cyclopropane]-7-amine

N-tert-butyl-2-methylspiro[1,3-dihydroisoquinoline-4,1'-cyclopropane]-7-amine (PubChem CID 155362648) has the molecular formula C16H24N2 and a molecular weight of 244.38 g/mol. Its IUPAC name is N-tert-butyl-2-methylspiro[1,3-dihydroisoquinoline-4,1'-cyclopropane]-7-amine.

Molecular Properties

Compound NameN-tert-butyl-2-methylspiro[1,3-dihydroisoquinoline-4,1'-cyclopropane]-7-amine
PubChem CID155362648
Molecular FormulaC16H24N2
Molecular Weight244.38 g/mol
Exact Mass244.19
IUPAC NameN-tert-butyl-2-methylspiro[1,3-dihydroisoquinoline-4,1'-cyclopropane]-7-amine
SMILESCN1Cc2cc(NC(C)(C)C)ccc2C2(CC2)C1
InChIInChI=1S/C16H24N2/c1-15(2,3)17-13-5-6-14-12(9-13)10-18(4)11-16(14)7-8-16/h5-6,9,17H,7-8,10-11H2,1-4H3
InChIKeyYRODLXDIHGAZIK-UHFFFAOYSA-N
XLogP3.37
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.38
LogP ≤ 53.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-tert-butyl-2-methylspiro[1,3-dihydroisoquinoline-4,1'-cyclopropane]-7-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-methyl-7-propan-2-ylspiro[1,3-dihydroisoquinoline-4,1'-cyclopropane]
CID 156637555
N-tert-butyl-1,4-dimethyl-3,5-dihydro-2H-1,4-benzodiazepin-7-amine
CID 155362654
2-methyl-6-propylspiro[1,3-dihydroisoquinoline-4,1'-cyclopropane]
CID 170254660
N-tert-butyl-2,3-dihydro-1H-inden-5-amine;ethane
CID 167619505
5-(tert-butylamino)-2-methyl-3H-isoindol-1-one
CID 155362630
2-methyl-N-(2-methylpropyl)-1,3-dihydroisoindol-5-amine
CID 115876895
2-(7-ethylspiro[1,3-dihydroisoquinoline-4,1'-cyclopropane]-2-yl)ethanol
CID 171522905
N-tert-butyl-2-(2,2-difluoroethyl)spiro[1,3-dihydroisoquinoline-4,1'-cyclopropane]-7-amine;N-tert-butyl-1,4-dimethyl-3,5-dihydro-2H-1,4-benzodiazepin-7-amine;N-tert-butyl-2-ethylspiro[1,3-dihydroisoquinoline-4,1'-cyclopropane]-7-amine;N-tert-butyl-4-methyl-3,5-dihydro-2H-1,4-benzoxazepin-7-amine;N-tert-butyl-2-methylspiro[1,3-dihydroisoquinoline-4,1'-cyclopropane]-7-amine;N-tert-butyl-2-propan-2-ylspiro[1,3-dihydroisoquinoline-4,1'-cyclopropane]-7-amine;N-tert-butyl-1,1,2-trimethyl-3,4-dihydroisoquinolin-7-amine;N-tert-butyl-2,4,4-trimethyl-1,3-dihydroisoquinolin-7-amine;6-(2,2-dimethylpropyl)-2-methylspiro[1,3-dihydroisoquinoline-4,1'-cyclopropane];6-(2,2-dimethylpropyl)-2-propan-2-ylspiro[1,3-dihydroisoquinoline-4,1'-cyclopropane]
CID 158033039
7-tert-butyl-5-chloro-2-methylspiro[1,3-dihydroisoquinoline-4,1'-cyclopropane]
CID 171575376
ethyl 2-[(2-methylspiro[1,3-dihydroisoquinoline-4,1'-cyclopropane]-7-yl)amino]-4-(pyridine-3-carbonyl)pyrimidine-5-carboxylate
CID 71224472
(2-methyl-1,3-dihydroisoindol-5-yl)hydrazine
CID 55281459
2-methyl-7-(2-prop-2-enyl-2H-pyridin-1-yl)spiro[1,3-dihydroisoquinoline-4,1'-cyclopropane]
CID 90112464

Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-2-methylspiro[1,3-dihydroisoquinoline-4,1'-cyclopropane]-7-amine?
The IUPAC name of N-tert-butyl-2-methylspiro[1,3-dihydroisoquinoline-4,1'-cyclopropane]-7-amine (CID 155362648) is N-tert-butyl-2-methylspiro[1,3-dihydroisoquinoline-4,1'-cyclopropane]-7-amine.
What is the SMILES notation for N-tert-butyl-2-methylspiro[1,3-dihydroisoquinoline-4,1'-cyclopropane]-7-amine?
The canonical SMILES for N-tert-butyl-2-methylspiro[1,3-dihydroisoquinoline-4,1'-cyclopropane]-7-amine is CN1Cc2cc(NC(C)(C)C)ccc2C2(CC2)C1.
What is the InChIKey of N-tert-butyl-2-methylspiro[1,3-dihydroisoquinoline-4,1'-cyclopropane]-7-amine?
The InChIKey is YRODLXDIHGAZIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2/c1-15(2,3)17-13-5-6-14-12(9-13)10-18(4)11-16(14)7-8-16/h5-6,9,17H,7-8,10-11H2,1-4H3.
What are the key properties of N-tert-butyl-2-methylspiro[1,3-dihydroisoquinoline-4,1'-cyclopropane]-7-amine?
N-tert-butyl-2-methylspiro[1,3-dihydroisoquinoline-4,1'-cyclopropane]-7-amine has a molecular weight of 244.38 g/mol, XLogP of 3.37, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-2-methylspiro[1,3-dihydroisoquinoline-4,1'-cyclopropane]-7-amine is sourced from PubChem (CID 155362648), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).