6-chloro-N-(dicyclopropylmethyl)-2,2-dimethyl-1,3-dihydroinden-1-amine

C18H24ClN — CID 83066943

IUPAC6-chloro-N-(dicyclopropylmethyl)-2,2-dimethyl-1,3-dihydroinden-1-amine
SMILESCC1(C)Cc2ccc(Cl)cc2C1NC(C1CC1)C1CC1
InChIInChI=1S/C18H24ClN/c1-18(2)10-13-7-8-14(19)9-15(13)17(18)20-16(11-3-4-11)12-5-6-12/h7-9,11-12,16-17,20H,3-6,10H2,1-2H3
InChIKeyFBQVTYQEHKTJRQ-UHFFFAOYSA-N
MW289.85 g/mol
LogP4.74
Rot. Bonds4

About 6-chloro-N-(dicyclopropylmethyl)-2,2-dimethyl-1,3-dihydroinden-1-amine

6-chloro-N-(dicyclopropylmethyl)-2,2-dimethyl-1,3-dihydroinden-1-amine (PubChem CID 83066943) has the molecular formula C18H24ClN and a molecular weight of 289.85 g/mol. Its IUPAC name is 6-chloro-N-(dicyclopropylmethyl)-2,2-dimethyl-1,3-dihydroinden-1-amine.

Molecular Properties

Compound Name6-chloro-N-(dicyclopropylmethyl)-2,2-dimethyl-1,3-dihydroinden-1-amine
PubChem CID83066943
Molecular FormulaC18H24ClN
Molecular Weight289.85 g/mol
Exact Mass289.16
IUPAC Name6-chloro-N-(dicyclopropylmethyl)-2,2-dimethyl-1,3-dihydroinden-1-amine
SMILESCC1(C)Cc2ccc(Cl)cc2C1NC(C1CC1)C1CC1
InChIInChI=1S/C18H24ClN/c1-18(2)10-13-7-8-14(19)9-15(13)17(18)20-16(11-3-4-11)12-5-6-12/h7-9,11-12,16-17,20H,3-6,10H2,1-2H3
InChIKeyFBQVTYQEHKTJRQ-UHFFFAOYSA-N
XLogP4.74
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.85
LogP ≤ 54.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

6-chloro-2,2-dimethyl-N-pent-1-yn-3-yl-1,3-dihydroinden-1-amine
CID 114160530
6-chloro-2,2-dimethyl-N-[(1R)-1-thiophen-2-ylethyl]-1,3-dihydroinden-1-amine
CID 83067481
6-chloro-N-(4-methoxybutan-2-yl)-2,2-dimethyl-1,3-dihydroinden-1-amine
CID 83067478
6-chloro-2,2-dimethyl-N-[1-(1,3-thiazol-2-yl)ethyl]-1,3-dihydroinden-1-amine
CID 83066795
6-chloro-2,2-dimethyl-N-[3-(2-methylpropoxy)propyl]-1,3-dihydroinden-1-amine
CID 83067283
6-chloro-N-[1-(furan-2-yl)propan-2-yl]-2,2-dimethyl-1,3-dihydroinden-1-amine
CID 83066596
N-(4-bromophenyl)-6-chloro-2,2-dimethyl-1,3-dihydroinden-1-amine
CID 83065922
6-chloro-N-(4-chloro-2-iodophenyl)-2,2-dimethyl-1,3-dihydroinden-1-amine
CID 107631566
2-[(6-chloro-2,2-dimethyl-1,3-dihydroinden-1-yl)amino]-2-methylpropane-1,3-diol
CID 83066805
6-chloro-N-(2-chloroprop-2-enyl)-2,2-dimethyl-1,3-dihydroinden-1-amine
CID 113464540
3-[(6-chloro-2,2-dimethyl-1,3-dihydroinden-1-yl)amino]propan-1-ol
CID 83067295
4-[[(6-chloro-2,2-dimethyl-1,3-dihydroinden-1-yl)amino]methyl]cyclohexan-1-ol
CID 106125007

Frequently Asked Questions

What is the IUPAC name of 6-chloro-N-(dicyclopropylmethyl)-2,2-dimethyl-1,3-dihydroinden-1-amine?
The IUPAC name of 6-chloro-N-(dicyclopropylmethyl)-2,2-dimethyl-1,3-dihydroinden-1-amine (CID 83066943) is 6-chloro-N-(dicyclopropylmethyl)-2,2-dimethyl-1,3-dihydroinden-1-amine.
What is the SMILES notation for 6-chloro-N-(dicyclopropylmethyl)-2,2-dimethyl-1,3-dihydroinden-1-amine?
The canonical SMILES for 6-chloro-N-(dicyclopropylmethyl)-2,2-dimethyl-1,3-dihydroinden-1-amine is CC1(C)Cc2ccc(Cl)cc2C1NC(C1CC1)C1CC1.
What is the InChIKey of 6-chloro-N-(dicyclopropylmethyl)-2,2-dimethyl-1,3-dihydroinden-1-amine?
The InChIKey is FBQVTYQEHKTJRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24ClN/c1-18(2)10-13-7-8-14(19)9-15(13)17(18)20-16(11-3-4-11)12-5-6-12/h7-9,11-12,16-17,20H,3-6,10H2,1-2H3.
What are the key properties of 6-chloro-N-(dicyclopropylmethyl)-2,2-dimethyl-1,3-dihydroinden-1-amine?
6-chloro-N-(dicyclopropylmethyl)-2,2-dimethyl-1,3-dihydroinden-1-amine has a molecular weight of 289.85 g/mol, XLogP of 4.74, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-N-(dicyclopropylmethyl)-2,2-dimethyl-1,3-dihydroinden-1-amine is sourced from PubChem (CID 83066943), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).