1-[(1S)-2,3-dihydro-1H-inden-1-yl]piperazine

C13H18N2 — CID 30634298

IUPAC1-[(1S)-2,3-dihydro-1H-inden-1-yl]piperazine
SMILESc1ccc2c(c1)CC[C@@H]2N1CCNCC1
InChIInChI=1S/C13H18N2/c1-2-4-12-11(3-1)5-6-13(12)15-9-7-14-8-10-15/h1-4,13-14H,5-10H2/t13-/m0/s1
InChIKeyPWOUAMWQYHOLIB-ZDUSSCGKSA-N
MW202.30 g/mol
LogP1.58
Rot. Bonds1

About 1-[(1S)-2,3-dihydro-1H-inden-1-yl]piperazine

1-[(1S)-2,3-dihydro-1H-inden-1-yl]piperazine (PubChem CID 30634298) has the molecular formula C13H18N2 and a molecular weight of 202.30 g/mol. Its IUPAC name is 1-[(1S)-2,3-dihydro-1H-inden-1-yl]piperazine.

Molecular Properties

Compound Name1-[(1S)-2,3-dihydro-1H-inden-1-yl]piperazine
PubChem CID30634298
Molecular FormulaC13H18N2
Molecular Weight202.30 g/mol
Exact Mass202.15
IUPAC Name1-[(1S)-2,3-dihydro-1H-inden-1-yl]piperazine
SMILESc1ccc2c(c1)CC[C@@H]2N1CCNCC1
InChIInChI=1S/C13H18N2/c1-2-4-12-11(3-1)5-6-13(12)15-9-7-14-8-10-15/h1-4,13-14H,5-10H2/t13-/m0/s1
InChIKeyPWOUAMWQYHOLIB-ZDUSSCGKSA-N
XLogP1.58
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.30
LogP ≤ 51.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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1-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]pyrrolidine
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1-piperazin-1-yl-1,2,3,4-tetrahydroisoquinoline
CID 91044952
1-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]piperidine
CID 141000985
1-(2,3-dihydro-1H-inden-1-yl)-N,4-dimethylpiperidin-4-amine
CID 113282872
1-(1,2,3,4-tetrahydronaphthalen-2-yl)piperazine
CID 3596803
1-[2-[4-(2,3-dihydro-1H-inden-1-yl)piperazin-1-yl]ethyl]imidazolidin-2-one
CID 14208336
N,N-dimethyl-4-(1,4,7,10-tetrazacyclododec-1-yl)-1,2,3,4-tetrahydronaphthalen-2-amine
CID 140583940
[1-(2,3,4,5-tetrahydro-1H-2-benzazepin-5-yl)piperidin-4-yl]methanol
CID 103983164
[1-(1,2,3,4-tetrahydronaphthalen-1-yl)piperidin-4-yl]methanol
CID 110899348
6-[4-(2,3-dihydro-1H-inden-1-yl)piperazin-1-yl]-1H-pyrimidine-2,4-dione
CID 155564247

Frequently Asked Questions

What is the IUPAC name of 1-[(1S)-2,3-dihydro-1H-inden-1-yl]piperazine?
The IUPAC name of 1-[(1S)-2,3-dihydro-1H-inden-1-yl]piperazine (CID 30634298) is 1-[(1S)-2,3-dihydro-1H-inden-1-yl]piperazine.
What is the SMILES notation for 1-[(1S)-2,3-dihydro-1H-inden-1-yl]piperazine?
The canonical SMILES for 1-[(1S)-2,3-dihydro-1H-inden-1-yl]piperazine is c1ccc2c(c1)CC[C@@H]2N1CCNCC1.
What is the InChIKey of 1-[(1S)-2,3-dihydro-1H-inden-1-yl]piperazine?
The InChIKey is PWOUAMWQYHOLIB-ZDUSSCGKSA-N. The full InChI is InChI=1S/C13H18N2/c1-2-4-12-11(3-1)5-6-13(12)15-9-7-14-8-10-15/h1-4,13-14H,5-10H2/t13-/m0/s1.
What are the key properties of 1-[(1S)-2,3-dihydro-1H-inden-1-yl]piperazine?
1-[(1S)-2,3-dihydro-1H-inden-1-yl]piperazine has a molecular weight of 202.30 g/mol, XLogP of 1.58, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(1S)-2,3-dihydro-1H-inden-1-yl]piperazine is sourced from PubChem (CID 30634298), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).