N-tert-butyl-1-[[1-(methylamino)cyclopropyl]methyl]indol-5-amine

C17H25N3 — CID 155362635

IUPACN-tert-butyl-1-[[1-(methylamino)cyclopropyl]methyl]indol-5-amine
SMILESCNC1(Cn2ccc3cc(NC(C)(C)C)ccc32)CC1
InChIInChI=1S/C17H25N3/c1-16(2,3)19-14-5-6-15-13(11-14)7-10-20(15)12-17(18-4)8-9-17/h5-7,10-11,18-19H,8-9,12H2,1-4H3
InChIKeyOXWOUBYXMOAEIQ-UHFFFAOYSA-N
MW271.41 g/mol
LogP3.60
Rot. Bonds4

About N-tert-butyl-1-[[1-(methylamino)cyclopropyl]methyl]indol-5-amine

N-tert-butyl-1-[[1-(methylamino)cyclopropyl]methyl]indol-5-amine (PubChem CID 155362635) has the molecular formula C17H25N3 and a molecular weight of 271.41 g/mol. Its IUPAC name is N-tert-butyl-1-[[1-(methylamino)cyclopropyl]methyl]indol-5-amine.

Molecular Properties

Compound NameN-tert-butyl-1-[[1-(methylamino)cyclopropyl]methyl]indol-5-amine
PubChem CID155362635
Molecular FormulaC17H25N3
Molecular Weight271.41 g/mol
Exact Mass271.20
IUPAC NameN-tert-butyl-1-[[1-(methylamino)cyclopropyl]methyl]indol-5-amine
SMILESCNC1(Cn2ccc3cc(NC(C)(C)C)ccc32)CC1
InChIInChI=1S/C17H25N3/c1-16(2,3)19-14-5-6-15-13(11-14)7-10-20(15)12-17(18-4)8-9-17/h5-7,10-11,18-19H,8-9,12H2,1-4H3
InChIKeyOXWOUBYXMOAEIQ-UHFFFAOYSA-N
XLogP3.60
TPSA28.99 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.41
LogP ≤ 53.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-tert-butyl-1-[[1-(methylamino)cyclopropyl]methyl]indol-5-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

1-[[1-(methylamino)cyclopropyl]methyl]indol-5-amine
CID 146338251
N-tert-butyl-1-methylindol-6-amine
CID 146573686
N-tert-butyl-1-methylindazol-5-amine
CID 58709852
N-[(1-hydroxycyclopentyl)methyl]-N'-(1-propylindol-5-yl)oxamide
CID 111435497
1-amino-N-[1-[2-(diethylamino)-2-oxoethyl]indol-5-yl]cyclopropane-1-carboxamide
CID 119764130
1-(1-hydroxy-2-methylpropan-2-yl)-3-[1-(2-methylpropyl)indol-5-yl]urea
CID 111976911
1-(2,2-dimethylpropyl)-5-methylindole
CID 90966063
1-(2-hydroxy-2-methylpropyl)-1-methyl-3-(1-propylindol-5-yl)urea
CID 111926333
1-(2,2-difluoropropyl)indol-5-amine
CID 165472066
2-[5-(methylamino)indol-1-yl]ethyl acetate
CID 174496711
2-methylsulfanyl-N-(1-propylindol-5-yl)acetamide
CID 49498410
2-[1-[(5-methoxyindol-1-yl)methyl]cyclopropyl]ethanamine
CID 65481736

Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-1-[[1-(methylamino)cyclopropyl]methyl]indol-5-amine?
The IUPAC name of N-tert-butyl-1-[[1-(methylamino)cyclopropyl]methyl]indol-5-amine (CID 155362635) is N-tert-butyl-1-[[1-(methylamino)cyclopropyl]methyl]indol-5-amine.
What is the SMILES notation for N-tert-butyl-1-[[1-(methylamino)cyclopropyl]methyl]indol-5-amine?
The canonical SMILES for N-tert-butyl-1-[[1-(methylamino)cyclopropyl]methyl]indol-5-amine is CNC1(Cn2ccc3cc(NC(C)(C)C)ccc32)CC1.
What is the InChIKey of N-tert-butyl-1-[[1-(methylamino)cyclopropyl]methyl]indol-5-amine?
The InChIKey is OXWOUBYXMOAEIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25N3/c1-16(2,3)19-14-5-6-15-13(11-14)7-10-20(15)12-17(18-4)8-9-17/h5-7,10-11,18-19H,8-9,12H2,1-4H3.
What are the key properties of N-tert-butyl-1-[[1-(methylamino)cyclopropyl]methyl]indol-5-amine?
N-tert-butyl-1-[[1-(methylamino)cyclopropyl]methyl]indol-5-amine has a molecular weight of 271.41 g/mol, XLogP of 3.60, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-1-[[1-(methylamino)cyclopropyl]methyl]indol-5-amine is sourced from PubChem (CID 155362635), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).