1,4-dimethyl-5,6,7,8,9,10-hexahydrocyclohepta[b]indol-10-amine

C15H20N2 — CID 107384140

IUPAC1,4-dimethyl-5,6,7,8,9,10-hexahydrocyclohepta[b]indol-10-amine
SMILESCc1ccc(C)c2c3c([nH]c12)CCCCC3N
InChIInChI=1S/C15H20N2/c1-9-7-8-10(2)15-13(9)14-11(16)5-3-4-6-12(14)17-15/h7-8,11,17H,3-6,16H2,1-2H3
InChIKeyFJYLGOLAUWXCKJ-UHFFFAOYSA-N
MW228.34 g/mol
LogP3.51
Rot. Bonds

About 1,4-dimethyl-5,6,7,8,9,10-hexahydrocyclohepta[b]indol-10-amine

1,4-dimethyl-5,6,7,8,9,10-hexahydrocyclohepta[b]indol-10-amine (PubChem CID 107384140) has the molecular formula C15H20N2 and a molecular weight of 228.34 g/mol. Its IUPAC name is 1,4-dimethyl-5,6,7,8,9,10-hexahydrocyclohepta[b]indol-10-amine.

Molecular Properties

Compound Name1,4-dimethyl-5,6,7,8,9,10-hexahydrocyclohepta[b]indol-10-amine
PubChem CID107384140
Molecular FormulaC15H20N2
Molecular Weight228.34 g/mol
Exact Mass228.16
IUPAC Name1,4-dimethyl-5,6,7,8,9,10-hexahydrocyclohepta[b]indol-10-amine
SMILESCc1ccc(C)c2c3c([nH]c12)CCCCC3N
InChIInChI=1S/C15H20N2/c1-9-7-8-10(2)15-13(9)14-11(16)5-3-4-6-12(14)17-15/h7-8,11,17H,3-6,16H2,1-2H3
InChIKeyFJYLGOLAUWXCKJ-UHFFFAOYSA-N
XLogP3.51
TPSA41.81 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.34
LogP ≤ 53.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

Analyze 1,4-dimethyl-5,6,7,8,9,10-hexahydrocyclohepta[b]indol-10-amine with MolForge

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Related Compounds

N-ethyl-1,4-dimethyl-5,6,7,8,9,10-hexahydrocyclohepta[b]indol-10-amine
CID 107384139
4-chloro-5,6,7,8,9,10-hexahydrocyclohepta[b]indol-10-amine
CID 107384143
(5,8-dimethyl-2,3,4,9-tetrahydro-1H-carbazol-1-yl)methanamine
CID 83840077
8-fluoro-2,3,4,9-tetrahydro-1H-carbazol-4-amine
CID 65333032
(5S)-1-ethoxy-4-methyl-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-amine
CID 79014230
2,4,5,8-tetramethyl-2,3,4,9-tetrahydro-1H-carbazole
CID 65335539
2-(7,8-dimethyl-2,3,4,9-tetrahydro-1H-carbazol-4-yl)acetic acid
CID 84742392
1-(5,8-dimethyl-2,3,4,9-tetrahydro-1H-carbazol-1-yl)-N-methylmethanamine
CID 84630576
(1S)-8-chloro-7-methyl-1,2,3,4-tetrahydronaphthalen-1-amine
CID 130648464
1,4-dibromo-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-amine
CID 62736180
5,8-dimethyl-2,3,4,9-tetrahydro-1H-carbazole-1-carboxylic acid
CID 82386293
6-methoxy-2,3,4,9-tetrahydro-1H-carbazol-4-amine
CID 65332552

Frequently Asked Questions

What is the IUPAC name of 1,4-dimethyl-5,6,7,8,9,10-hexahydrocyclohepta[b]indol-10-amine?
The IUPAC name of 1,4-dimethyl-5,6,7,8,9,10-hexahydrocyclohepta[b]indol-10-amine (CID 107384140) is 1,4-dimethyl-5,6,7,8,9,10-hexahydrocyclohepta[b]indol-10-amine.
What is the SMILES notation for 1,4-dimethyl-5,6,7,8,9,10-hexahydrocyclohepta[b]indol-10-amine?
The canonical SMILES for 1,4-dimethyl-5,6,7,8,9,10-hexahydrocyclohepta[b]indol-10-amine is Cc1ccc(C)c2c3c([nH]c12)CCCCC3N.
What is the InChIKey of 1,4-dimethyl-5,6,7,8,9,10-hexahydrocyclohepta[b]indol-10-amine?
The InChIKey is FJYLGOLAUWXCKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2/c1-9-7-8-10(2)15-13(9)14-11(16)5-3-4-6-12(14)17-15/h7-8,11,17H,3-6,16H2,1-2H3.
What are the key properties of 1,4-dimethyl-5,6,7,8,9,10-hexahydrocyclohepta[b]indol-10-amine?
1,4-dimethyl-5,6,7,8,9,10-hexahydrocyclohepta[b]indol-10-amine has a molecular weight of 228.34 g/mol, XLogP of 3.51, 0 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,4-dimethyl-5,6,7,8,9,10-hexahydrocyclohepta[b]indol-10-amine is sourced from PubChem (CID 107384140), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).