[1-(azocan-1-yl)-3-methylcyclopentyl]methanamine

C14H28N2 — CID 64501768

IUPAC[1-(azocan-1-yl)-3-methylcyclopentyl]methanamine
SMILESCC1CCC(CN)(N2CCCCCCC2)C1
InChIInChI=1S/C14H28N2/c1-13-7-8-14(11-13,12-15)16-9-5-3-2-4-6-10-16/h13H,2-12,15H2,1H3
InChIKeyOFNDKZHOPNNEHX-UHFFFAOYSA-N
MW224.39 g/mol
LogP2.77
Rot. Bonds2

About [1-(azocan-1-yl)-3-methylcyclopentyl]methanamine

[1-(azocan-1-yl)-3-methylcyclopentyl]methanamine (PubChem CID 64501768) has the molecular formula C14H28N2 and a molecular weight of 224.39 g/mol. Its IUPAC name is [1-(azocan-1-yl)-3-methylcyclopentyl]methanamine.

Molecular Properties

Compound Name[1-(azocan-1-yl)-3-methylcyclopentyl]methanamine
PubChem CID64501768
Molecular FormulaC14H28N2
Molecular Weight224.39 g/mol
Exact Mass224.23
IUPAC Name[1-(azocan-1-yl)-3-methylcyclopentyl]methanamine
SMILESCC1CCC(CN)(N2CCCCCCC2)C1
InChIInChI=1S/C14H28N2/c1-13-7-8-14(11-13,12-15)16-9-5-3-2-4-6-10-16/h13H,2-12,15H2,1H3
InChIKeyOFNDKZHOPNNEHX-UHFFFAOYSA-N
XLogP2.77
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.39
LogP ≤ 52.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(3-methyl-1-pyrrolidin-1-ylcyclohexyl)methanamine
CID 24695310
[3-methyl-1-(4-piperidin-1-ylpiperidin-1-yl)cyclopentyl]methanamine
CID 64501577
[1-(4,4-dimethylpiperidin-1-yl)-3-methylcyclopentyl]methanamine
CID 64500940
[4-methyl-1-(4-methylazepan-1-yl)cyclohexyl]methanamine
CID 63623138
[3-methyl-1-(4-methyl-1,4-diazepan-1-yl)cyclohexyl]methanamine
CID 43209340
[1-(4-butan-2-ylpiperazin-1-yl)-3-methylcyclopentyl]methanamine
CID 64500744
(2-methyl-1,2,3,5,6,7-hexahydropyrrolizin-8-yl)methanamine
CID 159003358
[4-methyl-1-(1,4-oxazepan-4-yl)cyclohexyl]methanamine
CID 62987611
[1-[4-(4-fluorophenyl)piperazin-1-yl]-3-methylcyclopentyl]methanamine
CID 64500314
[1-(4-benzylpiperidin-1-yl)-3-methylcyclopentyl]methanamine
CID 64500748
2-[1-(azepan-1-yl)-4-methylcyclohexyl]acetic acid
CID 64527329
[1-(4-methylazepan-1-yl)-4-propan-2-ylcyclohexyl]methanamine
CID 55248044

Frequently Asked Questions

What is the IUPAC name of [1-(azocan-1-yl)-3-methylcyclopentyl]methanamine?
The IUPAC name of [1-(azocan-1-yl)-3-methylcyclopentyl]methanamine (CID 64501768) is [1-(azocan-1-yl)-3-methylcyclopentyl]methanamine.
What is the SMILES notation for [1-(azocan-1-yl)-3-methylcyclopentyl]methanamine?
The canonical SMILES for [1-(azocan-1-yl)-3-methylcyclopentyl]methanamine is CC1CCC(CN)(N2CCCCCCC2)C1.
What is the InChIKey of [1-(azocan-1-yl)-3-methylcyclopentyl]methanamine?
The InChIKey is OFNDKZHOPNNEHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2/c1-13-7-8-14(11-13,12-15)16-9-5-3-2-4-6-10-16/h13H,2-12,15H2,1H3.
What are the key properties of [1-(azocan-1-yl)-3-methylcyclopentyl]methanamine?
[1-(azocan-1-yl)-3-methylcyclopentyl]methanamine has a molecular weight of 224.39 g/mol, XLogP of 2.77, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(azocan-1-yl)-3-methylcyclopentyl]methanamine is sourced from PubChem (CID 64501768), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).