2-N,2-N-dimethyl-1-propyl-2,3-dihydroindene-1,2-diamine

C14H22N2 — CID 43830978

IUPAC2-N,2-N-dimethyl-1-propyl-2,3-dihydroindene-1,2-diamine
SMILESCCCC1(N)c2ccccc2CC1N(C)C
InChIInChI=1S/C14H22N2/c1-4-9-14(15)12-8-6-5-7-11(12)10-13(14)16(2)3/h5-8,13H,4,9-10,15H2,1-3H3
InChIKeyWZZRGRKKJABDGA-UHFFFAOYSA-N
MW218.34 g/mol
LogP2.13
Rot. Bonds3

About 2-N,2-N-dimethyl-1-propyl-2,3-dihydroindene-1,2-diamine

2-N,2-N-dimethyl-1-propyl-2,3-dihydroindene-1,2-diamine (PubChem CID 43830978) has the molecular formula C14H22N2 and a molecular weight of 218.34 g/mol. Its IUPAC name is 2-N,2-N-dimethyl-1-propyl-2,3-dihydroindene-1,2-diamine.

Molecular Properties

Compound Name2-N,2-N-dimethyl-1-propyl-2,3-dihydroindene-1,2-diamine
PubChem CID43830978
Molecular FormulaC14H22N2
Molecular Weight218.34 g/mol
Exact Mass218.18
IUPAC Name2-N,2-N-dimethyl-1-propyl-2,3-dihydroindene-1,2-diamine
SMILESCCCC1(N)c2ccccc2CC1N(C)C
InChIInChI=1S/C14H22N2/c1-4-9-14(15)12-8-6-5-7-11(12)10-13(14)16(2)3/h5-8,13H,4,9-10,15H2,1-3H3
InChIKeyWZZRGRKKJABDGA-UHFFFAOYSA-N
XLogP2.13
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.34
LogP ≤ 52.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-N,2-N-dimethyl-1-propyl-2,3-dihydroindene-1,2-diamine?
The IUPAC name of 2-N,2-N-dimethyl-1-propyl-2,3-dihydroindene-1,2-diamine (CID 43830978) is 2-N,2-N-dimethyl-1-propyl-2,3-dihydroindene-1,2-diamine.
What is the SMILES notation for 2-N,2-N-dimethyl-1-propyl-2,3-dihydroindene-1,2-diamine?
The canonical SMILES for 2-N,2-N-dimethyl-1-propyl-2,3-dihydroindene-1,2-diamine is CCCC1(N)c2ccccc2CC1N(C)C.
What is the InChIKey of 2-N,2-N-dimethyl-1-propyl-2,3-dihydroindene-1,2-diamine?
The InChIKey is WZZRGRKKJABDGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2/c1-4-9-14(15)12-8-6-5-7-11(12)10-13(14)16(2)3/h5-8,13H,4,9-10,15H2,1-3H3.
What are the key properties of 2-N,2-N-dimethyl-1-propyl-2,3-dihydroindene-1,2-diamine?
2-N,2-N-dimethyl-1-propyl-2,3-dihydroindene-1,2-diamine has a molecular weight of 218.34 g/mol, XLogP of 2.13, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N,2-N-dimethyl-1-propyl-2,3-dihydroindene-1,2-diamine is sourced from PubChem (CID 43830978), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).