N-cyclopropyl-4-fluoro-N-(piperidin-4-ylmethyl)-2,3-dihydro-1H-inden-1-amine

C18H25FN2 — CID 83059884

IUPACN-cyclopropyl-4-fluoro-N-(piperidin-4-ylmethyl)-2,3-dihydro-1H-inden-1-amine
SMILESFc1cccc2c1CCC2N(CC1CCNCC1)C1CC1
InChIInChI=1S/C18H25FN2/c19-17-3-1-2-16-15(17)6-7-18(16)21(14-4-5-14)12-13-8-10-20-11-9-13/h1-3,13-14,18,20H,4-12H2
InChIKeyAMEWKQJRLXDHAG-UHFFFAOYSA-N
MW288.41 g/mol
LogP3.28
Rot. Bonds4

About N-cyclopropyl-4-fluoro-N-(piperidin-4-ylmethyl)-2,3-dihydro-1H-inden-1-amine

N-cyclopropyl-4-fluoro-N-(piperidin-4-ylmethyl)-2,3-dihydro-1H-inden-1-amine (PubChem CID 83059884) has the molecular formula C18H25FN2 and a molecular weight of 288.41 g/mol. Its IUPAC name is N-cyclopropyl-4-fluoro-N-(piperidin-4-ylmethyl)-2,3-dihydro-1H-inden-1-amine.

Molecular Properties

Compound NameN-cyclopropyl-4-fluoro-N-(piperidin-4-ylmethyl)-2,3-dihydro-1H-inden-1-amine
PubChem CID83059884
Molecular FormulaC18H25FN2
Molecular Weight288.41 g/mol
Exact Mass288.20
IUPAC NameN-cyclopropyl-4-fluoro-N-(piperidin-4-ylmethyl)-2,3-dihydro-1H-inden-1-amine
SMILESFc1cccc2c1CCC2N(CC1CCNCC1)C1CC1
InChIInChI=1S/C18H25FN2/c19-17-3-1-2-16-15(17)6-7-18(16)21(14-4-5-14)12-13-8-10-20-11-9-13/h1-3,13-14,18,20H,4-12H2
InChIKeyAMEWKQJRLXDHAG-UHFFFAOYSA-N
XLogP3.28
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.41
LogP ≤ 53.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-cyclopropyl-5-fluoro-N-(piperidin-4-ylmethyl)-2,3-dihydro-1H-inden-1-amine
CID 116531501
N-(4-fluoro-2,3-dihydro-1H-inden-1-yl)-N-propylpyrrolidin-3-amine
CID 83069157
3-[cyclopropyl-(4-fluoro-2,3-dihydro-1H-inden-1-yl)amino]propanoic acid
CID 83069274
N-cyclopropyl-N-(cyclopropylmethyl)-2,3,4,5-tetrahydro-1H-2-benzazepin-5-amine
CID 103983485
N-cyclopropyl-N-(piperidin-4-ylmethyl)cyclobutanamine
CID 79716019
4-fluoro-N-(piperidin-2-ylmethyl)-N-propan-2-yl-2,3-dihydro-1H-inden-1-amine
CID 106622203
4-fluoro-N-propyl-N-(pyrrolidin-2-ylmethyl)-2,3-dihydro-1H-inden-1-amine
CID 106604082
2-N-cyclopropyl-1-N-(4-fluoro-2,3-dihydro-1H-inden-1-yl)-2-N-methylpropane-1,2-diamine
CID 103781629
4-[[3-fluoro-2-(trifluoromethyl)phenyl]methyl]piperidine
CID 84806750
N-methyl-N-(piperidin-4-ylmethyl)-2,3-dihydro-1H-inden-1-amine;hydrochloride
CID 119929963
4-[(2-fluorophenyl)methyl]piperidine;hydrochloride
CID 46172843
2-fluoro-N,N-dimethyl-6-(piperidin-4-ylmethyl)aniline
CID 117117895

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-4-fluoro-N-(piperidin-4-ylmethyl)-2,3-dihydro-1H-inden-1-amine?
The IUPAC name of N-cyclopropyl-4-fluoro-N-(piperidin-4-ylmethyl)-2,3-dihydro-1H-inden-1-amine (CID 83059884) is N-cyclopropyl-4-fluoro-N-(piperidin-4-ylmethyl)-2,3-dihydro-1H-inden-1-amine.
What is the SMILES notation for N-cyclopropyl-4-fluoro-N-(piperidin-4-ylmethyl)-2,3-dihydro-1H-inden-1-amine?
The canonical SMILES for N-cyclopropyl-4-fluoro-N-(piperidin-4-ylmethyl)-2,3-dihydro-1H-inden-1-amine is Fc1cccc2c1CCC2N(CC1CCNCC1)C1CC1.
What is the InChIKey of N-cyclopropyl-4-fluoro-N-(piperidin-4-ylmethyl)-2,3-dihydro-1H-inden-1-amine?
The InChIKey is AMEWKQJRLXDHAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25FN2/c19-17-3-1-2-16-15(17)6-7-18(16)21(14-4-5-14)12-13-8-10-20-11-9-13/h1-3,13-14,18,20H,4-12H2.
What are the key properties of N-cyclopropyl-4-fluoro-N-(piperidin-4-ylmethyl)-2,3-dihydro-1H-inden-1-amine?
N-cyclopropyl-4-fluoro-N-(piperidin-4-ylmethyl)-2,3-dihydro-1H-inden-1-amine has a molecular weight of 288.41 g/mol, XLogP of 3.28, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-4-fluoro-N-(piperidin-4-ylmethyl)-2,3-dihydro-1H-inden-1-amine is sourced from PubChem (CID 83059884), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).