N-[2-(1-methylpiperidin-4-yl)ethyl]cyclooctanamine

C16H32N2 — CID 115717422

IUPACN-[2-(1-methylpiperidin-4-yl)ethyl]cyclooctanamine
SMILESCN1CCC(CCNC2CCCCCCC2)CC1
InChIInChI=1S/C16H32N2/c1-18-13-10-15(11-14-18)9-12-17-16-7-5-3-2-4-6-8-16/h15-17H,2-14H2,1H3
InChIKeyQQWURGFTAKTFRS-UHFFFAOYSA-N
MW252.45 g/mol
LogP3.42
Rot. Bonds4

About N-[2-(1-methylpiperidin-4-yl)ethyl]cyclooctanamine

N-[2-(1-methylpiperidin-4-yl)ethyl]cyclooctanamine (PubChem CID 115717422) has the molecular formula C16H32N2 and a molecular weight of 252.45 g/mol. Its IUPAC name is N-[2-(1-methylpiperidin-4-yl)ethyl]cyclooctanamine.

Molecular Properties

Compound NameN-[2-(1-methylpiperidin-4-yl)ethyl]cyclooctanamine
PubChem CID115717422
Molecular FormulaC16H32N2
Molecular Weight252.45 g/mol
Exact Mass252.26
IUPAC NameN-[2-(1-methylpiperidin-4-yl)ethyl]cyclooctanamine
SMILESCN1CCC(CCNC2CCCCCCC2)CC1
InChIInChI=1S/C16H32N2/c1-18-13-10-15(11-14-18)9-12-17-16-7-5-3-2-4-6-8-16/h15-17H,2-14H2,1H3
InChIKeyQQWURGFTAKTFRS-UHFFFAOYSA-N
XLogP3.42
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.45
LogP ≤ 53.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-cyclobutylethyl)-1-methylpiperidin-4-amine
CID 115893453
4-ethyl-N-[2-(1-methylpiperidin-4-yl)ethyl]cycloheptan-1-amine
CID 114515181
N-(2-cycloundecylethyl)cyclodecanamine
CID 155180877
N-(2-cycloheptylethyl)cyclopentanamine
CID 114457795
3-methyl-N-[2-(1-methylpiperidin-4-yl)ethyl]cyclobutan-1-amine
CID 104859771
N-[2-(1-methylpiperidin-4-yl)ethyl]-3-propan-2-ylcyclohexan-1-amine
CID 107448828
4-(2-methylbutan-2-yl)-N-[2-(1-methylpiperidin-4-yl)ethyl]cyclohexan-1-amine
CID 115653405
N-[2-(1-methylpiperidin-4-yl)ethyl]oxolan-3-amine
CID 115689075
N-[2-(1-methylpiperidin-4-yl)ethyl]-3-methylsulfonylcyclohexan-1-amine
CID 114515525
1-cyclohexyl-3-[2-(1-methylpiperidin-4-yl)ethyl]urea
CID 115611118
N-[2-(4-methylpiperazin-1-yl)ethyl]cyclohexanamine
CID 60701363
N-[2-(1-methylpiperidin-4-yl)ethyl]-2-(trifluoromethyl)cyclohexan-1-amine
CID 114515257

Frequently Asked Questions

What is the IUPAC name of N-[2-(1-methylpiperidin-4-yl)ethyl]cyclooctanamine?
The IUPAC name of N-[2-(1-methylpiperidin-4-yl)ethyl]cyclooctanamine (CID 115717422) is N-[2-(1-methylpiperidin-4-yl)ethyl]cyclooctanamine.
What is the SMILES notation for N-[2-(1-methylpiperidin-4-yl)ethyl]cyclooctanamine?
The canonical SMILES for N-[2-(1-methylpiperidin-4-yl)ethyl]cyclooctanamine is CN1CCC(CCNC2CCCCCCC2)CC1.
What is the InChIKey of N-[2-(1-methylpiperidin-4-yl)ethyl]cyclooctanamine?
The InChIKey is QQWURGFTAKTFRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32N2/c1-18-13-10-15(11-14-18)9-12-17-16-7-5-3-2-4-6-8-16/h15-17H,2-14H2,1H3.
What are the key properties of N-[2-(1-methylpiperidin-4-yl)ethyl]cyclooctanamine?
N-[2-(1-methylpiperidin-4-yl)ethyl]cyclooctanamine has a molecular weight of 252.45 g/mol, XLogP of 3.42, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(1-methylpiperidin-4-yl)ethyl]cyclooctanamine is sourced from PubChem (CID 115717422), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).