(1R)-5,6-diethyl-3,3-dimethyl-1,2-dihydroinden-1-amine

C15H23N — CID 115483206

IUPAC(1R)-5,6-diethyl-3,3-dimethyl-1,2-dihydroinden-1-amine
SMILESCCc1cc2c(cc1CC)C(C)(C)C[C@H]2N
InChIInChI=1S/C15H23N/c1-5-10-7-12-13(8-11(10)6-2)15(3,4)9-14(12)16/h7-8,14H,5-6,9,16H2,1-4H3/t14-/m1/s1
InChIKeyKVJBHFQTZFCSTM-CQSZACIVSA-N
MW217.36 g/mol
LogP3.49
Rot. Bonds2

About (1R)-5,6-diethyl-3,3-dimethyl-1,2-dihydroinden-1-amine

(1R)-5,6-diethyl-3,3-dimethyl-1,2-dihydroinden-1-amine (PubChem CID 115483206) has the molecular formula C15H23N and a molecular weight of 217.36 g/mol. Its IUPAC name is (1R)-5,6-diethyl-3,3-dimethyl-1,2-dihydroinden-1-amine.

Molecular Properties

Compound Name(1R)-5,6-diethyl-3,3-dimethyl-1,2-dihydroinden-1-amine
PubChem CID115483206
Molecular FormulaC15H23N
Molecular Weight217.36 g/mol
Exact Mass217.18
IUPAC Name(1R)-5,6-diethyl-3,3-dimethyl-1,2-dihydroinden-1-amine
SMILESCCc1cc2c(cc1CC)C(C)(C)C[C@H]2N
InChIInChI=1S/C15H23N/c1-5-10-7-12-13(8-11(10)6-2)15(3,4)9-14(12)16/h7-8,14H,5-6,9,16H2,1-4H3/t14-/m1/s1
InChIKeyKVJBHFQTZFCSTM-CQSZACIVSA-N
XLogP3.49
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.36
LogP ≤ 53.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(1R)-3,3-dimethyl-2,5,6,7-tetrahydro-1H-s-indacen-1-amine
CID 115483155
3,3-dimethyl-6-nitro-1,2-dihydroinden-1-amine
CID 19365901
(1S)-6,7-diethyl-4-methyl-1,2,3,4-tetrahydronaphthalen-1-amine
CID 115483191
1-(6-ethyl-1,1-dimethyl-3-propan-2-yl-2,3-dihydroinden-5-yl)ethanone
CID 20522451
(4S)-6-ethyl-2,2-dimethyl-3,4-dihydrochromen-4-amine
CID 42220642
2-amino-7-ethyl-4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-ol
CID 84623396
2-amino-7-bromo-4,4-dimethyl-2,3-dihydronaphthalen-1-one
CID 84640610
(4R)-4-amino-6-methoxy-2,2-dimethyl-3,4-dihydronaphthalen-1-one
CID 124562773
2,3-diethyl-7,7-dimethyl-5,6,8,9-tetrahydrobenzo[7]annulen-5-ol
CID 113319285
6-methoxy-3,3-dimethyl-2,4-dihydro-1H-naphthalen-1-amine
CID 84620622
1-butyl-6-methoxy-4,4-dimethyl-2,3-dihydro-1H-naphthalen-2-amine
CID 57359538
5,6-diethyl-2-methyl-1,3-dihydroinden-2-amine
CID 22499232

Frequently Asked Questions

What is the IUPAC name of (1R)-5,6-diethyl-3,3-dimethyl-1,2-dihydroinden-1-amine?
The IUPAC name of (1R)-5,6-diethyl-3,3-dimethyl-1,2-dihydroinden-1-amine (CID 115483206) is (1R)-5,6-diethyl-3,3-dimethyl-1,2-dihydroinden-1-amine.
What is the SMILES notation for (1R)-5,6-diethyl-3,3-dimethyl-1,2-dihydroinden-1-amine?
The canonical SMILES for (1R)-5,6-diethyl-3,3-dimethyl-1,2-dihydroinden-1-amine is CCc1cc2c(cc1CC)C(C)(C)C[C@H]2N.
What is the InChIKey of (1R)-5,6-diethyl-3,3-dimethyl-1,2-dihydroinden-1-amine?
The InChIKey is KVJBHFQTZFCSTM-CQSZACIVSA-N. The full InChI is InChI=1S/C15H23N/c1-5-10-7-12-13(8-11(10)6-2)15(3,4)9-14(12)16/h7-8,14H,5-6,9,16H2,1-4H3/t14-/m1/s1.
What are the key properties of (1R)-5,6-diethyl-3,3-dimethyl-1,2-dihydroinden-1-amine?
(1R)-5,6-diethyl-3,3-dimethyl-1,2-dihydroinden-1-amine has a molecular weight of 217.36 g/mol, XLogP of 3.49, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-5,6-diethyl-3,3-dimethyl-1,2-dihydroinden-1-amine is sourced from PubChem (CID 115483206), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).