1-methylspiro[1,3-dihydroindene-2,1'-cyclopentane]-4-amine

C14H19N — CID 118037152

IUPAC1-methylspiro[1,3-dihydroindene-2,1'-cyclopentane]-4-amine
SMILESCC1c2cccc(N)c2CC12CCCC2
InChIInChI=1S/C14H19N/c1-10-11-5-4-6-13(15)12(11)9-14(10)7-2-3-8-14/h4-6,10H,2-3,7-9,15H2,1H3
InChIKeyCCWSPDMXWRJPPF-UHFFFAOYSA-N
MW201.31 g/mol
LogP3.49
Rot. Bonds

About 1-methylspiro[1,3-dihydroindene-2,1'-cyclopentane]-4-amine

1-methylspiro[1,3-dihydroindene-2,1'-cyclopentane]-4-amine (PubChem CID 118037152) has the molecular formula C14H19N and a molecular weight of 201.31 g/mol. Its IUPAC name is 1-methylspiro[1,3-dihydroindene-2,1'-cyclopentane]-4-amine.

Molecular Properties

Compound Name1-methylspiro[1,3-dihydroindene-2,1'-cyclopentane]-4-amine
PubChem CID118037152
Molecular FormulaC14H19N
Molecular Weight201.31 g/mol
Exact Mass201.15
IUPAC Name1-methylspiro[1,3-dihydroindene-2,1'-cyclopentane]-4-amine
SMILESCC1c2cccc(N)c2CC12CCCC2
InChIInChI=1S/C14H19N/c1-10-11-5-4-6-13(15)12(11)9-14(10)7-2-3-8-14/h4-6,10H,2-3,7-9,15H2,1H3
InChIKeyCCWSPDMXWRJPPF-UHFFFAOYSA-N
XLogP3.49
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.31
LogP ≤ 53.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

(7R)-7-methylbicyclo[4.2.0]octa-1(6),2,4-trien-2-amine
CID 125469550
2-[(1S)-2,2-dimethylcyclohexyl]aniline
CID 125449178
1-N,1-N-dimethyl-2,3-dihydro-1H-indene-1,4-diamine
CID 105436662
2-[(1R)-2,2-dimethylcyclohexyl]aniline
CID 125449181
2-methyl-2,3-dihydro-1H-indol-4-amine
CID 130045562
(1R)-4-bromo-1,2,2-trimethyl-1,3-dihydroindene
CID 125499315
2,3-dihydro-1H-indene-1,4-diamine
CID 55293440
4-bromospiro[1,3-dihydroindene-2,1'-cyclopropane]-1-amine
CID 82277978
3-(1,4-dioxaspiro[4.5]decan-8-yl)-2-methylaniline
CID 125450132
2-[(1S,2S)-2-methylcyclohexyl]aniline
CID 124577862
5-amino-1,2,3,4-tetrahydronaphthalene-1-carbaldehyde
CID 174491506
2-[(1S)-3,3-dimethylcyclohexyl]aniline
CID 125450095

Frequently Asked Questions

What is the IUPAC name of 1-methylspiro[1,3-dihydroindene-2,1'-cyclopentane]-4-amine?
The IUPAC name of 1-methylspiro[1,3-dihydroindene-2,1'-cyclopentane]-4-amine (CID 118037152) is 1-methylspiro[1,3-dihydroindene-2,1'-cyclopentane]-4-amine.
What is the SMILES notation for 1-methylspiro[1,3-dihydroindene-2,1'-cyclopentane]-4-amine?
The canonical SMILES for 1-methylspiro[1,3-dihydroindene-2,1'-cyclopentane]-4-amine is CC1c2cccc(N)c2CC12CCCC2.
What is the InChIKey of 1-methylspiro[1,3-dihydroindene-2,1'-cyclopentane]-4-amine?
The InChIKey is CCWSPDMXWRJPPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N/c1-10-11-5-4-6-13(15)12(11)9-14(10)7-2-3-8-14/h4-6,10H,2-3,7-9,15H2,1H3.
What are the key properties of 1-methylspiro[1,3-dihydroindene-2,1'-cyclopentane]-4-amine?
1-methylspiro[1,3-dihydroindene-2,1'-cyclopentane]-4-amine has a molecular weight of 201.31 g/mol, XLogP of 3.49, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methylspiro[1,3-dihydroindene-2,1'-cyclopentane]-4-amine is sourced from PubChem (CID 118037152), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).