1-(pyrrolidin-1-ylmethyl)-2,3-dihydro-1H-inden-4-amine

C14H20N2 — CID 105470445

IUPAC1-(pyrrolidin-1-ylmethyl)-2,3-dihydro-1H-inden-4-amine
SMILESNc1cccc2c1CCC2CN1CCCC1
InChIInChI=1S/C14H20N2/c15-14-5-3-4-12-11(6-7-13(12)14)10-16-8-1-2-9-16/h3-5,11H,1-2,6-10,15H2
InChIKeyALLNBZUKJPZEGV-UHFFFAOYSA-N
MW216.33 g/mol
LogP2.39
Rot. Bonds2

About 1-(pyrrolidin-1-ylmethyl)-2,3-dihydro-1H-inden-4-amine

1-(pyrrolidin-1-ylmethyl)-2,3-dihydro-1H-inden-4-amine (PubChem CID 105470445) has the molecular formula C14H20N2 and a molecular weight of 216.33 g/mol. Its IUPAC name is 1-(pyrrolidin-1-ylmethyl)-2,3-dihydro-1H-inden-4-amine.

Molecular Properties

Compound Name1-(pyrrolidin-1-ylmethyl)-2,3-dihydro-1H-inden-4-amine
PubChem CID105470445
Molecular FormulaC14H20N2
Molecular Weight216.33 g/mol
Exact Mass216.16
IUPAC Name1-(pyrrolidin-1-ylmethyl)-2,3-dihydro-1H-inden-4-amine
SMILESNc1cccc2c1CCC2CN1CCCC1
InChIInChI=1S/C14H20N2/c15-14-5-3-4-12-11(6-7-13(12)14)10-16-8-1-2-9-16/h3-5,11H,1-2,6-10,15H2
InChIKeyALLNBZUKJPZEGV-UHFFFAOYSA-N
XLogP2.39
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.33
LogP ≤ 52.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 1-(pyrrolidin-1-ylmethyl)-2,3-dihydro-1H-inden-4-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

8-(pyrrolidin-1-ylmethyl)-5,6,7,8-tetrahydronaphthalen-1-amine
CID 105488680
2,3-dihydro-1H-indene-1,4-diamine
CID 55293440
4-(azetidin-1-ylmethyl)-8-chloro-1,2,3,4-tetrahydroquinoline
CID 105498664
3-(pyrrolidin-1-ylmethyl)-3,4-dihydro-2H-chromen-5-amine
CID 105491692
5-amino-1,2,3,4-tetrahydronaphthalene-1-carbaldehyde
CID 174491506
5-(3-pyrrolidin-1-ylpropoxy)-1,2,3,4-tetrahydronaphthalen-1-amine
CID 65454398
8-(azetidin-1-ylmethyl)-5,6,7,8-tetrahydronaphthalen-2-amine
CID 105470439
1-N,1-N-dimethyl-2,3-dihydro-1H-indene-1,4-diamine
CID 105436662
(1R)-4-amino-2,3-dihydro-1H-indene-1-carboxylic acid
CID 86332255
N'-hydroxy-1-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)piperidine-3-carboximidamide
CID 77041361
1-(2-bromoethyl)-4-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)piperazine
CID 80678906
2-(2-aminophenyl)-1-[1-(pyrrolidin-1-ylmethyl)-3,4-dihydro-1H-isoquinolin-2-yl]ethanone
CID 54409754

Frequently Asked Questions

What is the IUPAC name of 1-(pyrrolidin-1-ylmethyl)-2,3-dihydro-1H-inden-4-amine?
The IUPAC name of 1-(pyrrolidin-1-ylmethyl)-2,3-dihydro-1H-inden-4-amine (CID 105470445) is 1-(pyrrolidin-1-ylmethyl)-2,3-dihydro-1H-inden-4-amine.
What is the SMILES notation for 1-(pyrrolidin-1-ylmethyl)-2,3-dihydro-1H-inden-4-amine?
The canonical SMILES for 1-(pyrrolidin-1-ylmethyl)-2,3-dihydro-1H-inden-4-amine is Nc1cccc2c1CCC2CN1CCCC1.
What is the InChIKey of 1-(pyrrolidin-1-ylmethyl)-2,3-dihydro-1H-inden-4-amine?
The InChIKey is ALLNBZUKJPZEGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2/c15-14-5-3-4-12-11(6-7-13(12)14)10-16-8-1-2-9-16/h3-5,11H,1-2,6-10,15H2.
What are the key properties of 1-(pyrrolidin-1-ylmethyl)-2,3-dihydro-1H-inden-4-amine?
1-(pyrrolidin-1-ylmethyl)-2,3-dihydro-1H-inden-4-amine has a molecular weight of 216.33 g/mol, XLogP of 2.39, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(pyrrolidin-1-ylmethyl)-2,3-dihydro-1H-inden-4-amine is sourced from PubChem (CID 105470445), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).