N-(cyclopentylmethyl)-2-[4-(methoxymethyl)piperidin-1-yl]ethanamine

C15H30N2O — CID 63979713

IUPACN-(cyclopentylmethyl)-2-[4-(methoxymethyl)piperidin-1-yl]ethanamine
SMILESCOCC1CCN(CCNCC2CCCC2)CC1
InChIInChI=1S/C15H30N2O/c1-18-13-15-6-9-17(10-7-15)11-8-16-12-14-4-2-3-5-14/h14-16H,2-13H2,1H3
InChIKeyGIMQZWPHTLJXRO-UHFFFAOYSA-N
MW254.42 g/mol
LogP2.12
Rot. Bonds7

About N-(cyclopentylmethyl)-2-[4-(methoxymethyl)piperidin-1-yl]ethanamine

N-(cyclopentylmethyl)-2-[4-(methoxymethyl)piperidin-1-yl]ethanamine (PubChem CID 63979713) has the molecular formula C15H30N2O and a molecular weight of 254.42 g/mol. Its IUPAC name is N-(cyclopentylmethyl)-2-[4-(methoxymethyl)piperidin-1-yl]ethanamine.

Molecular Properties

Compound NameN-(cyclopentylmethyl)-2-[4-(methoxymethyl)piperidin-1-yl]ethanamine
PubChem CID63979713
Molecular FormulaC15H30N2O
Molecular Weight254.42 g/mol
Exact Mass254.24
IUPAC NameN-(cyclopentylmethyl)-2-[4-(methoxymethyl)piperidin-1-yl]ethanamine
SMILESCOCC1CCN(CCNCC2CCCC2)CC1
InChIInChI=1S/C15H30N2O/c1-18-13-15-6-9-17(10-7-15)11-8-16-12-14-4-2-3-5-14/h14-16H,2-13H2,1H3
InChIKeyGIMQZWPHTLJXRO-UHFFFAOYSA-N
XLogP2.12
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.42
LogP ≤ 52.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-(cyclopropylmethyl)-2-[4-(methoxymethyl)piperidin-1-yl]ethanamine
CID 63978168
N-[2-[4-(methoxymethyl)piperidin-1-yl]ethyl]-2-methylcyclohexan-1-amine
CID 63978745
N-(cyclopentylmethyl)-2-thiomorpholin-4-ylethanamine
CID 62574718
N-(cyclopentylmethyl)-2-(4-piperidin-1-ylpiperidin-1-yl)ethanamine
CID 62561801
N-(cyclohexylmethyl)-2-[4-(cyclopropylmethyl)piperazin-1-yl]ethanamine
CID 62557787
N-(cyclohexylmethyl)-2-morpholin-4-ylethanamine
CID 3155090
N-(cyclopentylmethyl)-2-(4-methylsulfonylpiperazin-1-yl)ethanamine
CID 63003319
N-[2-[3-(methoxymethyl)pyrrolidin-1-yl]ethyl]prop-2-yn-1-amine
CID 64582811
N-[2-[4-(methoxymethyl)piperidin-1-yl]ethyl]-3-methylcyclohexan-1-amine
CID 63979129
N-[[1-(cyclobutylmethyl)piperidin-4-yl]methyl]-2-methoxyethanamine
CID 65459890
N-(cyclohexylmethyl)-2-(4-ethyl-4-methylpiperidin-1-yl)ethanamine
CID 55196456
N-(cyclopentylmethyl)-3-(4-methylpiperazin-1-yl)propan-1-amine
CID 62069634

Frequently Asked Questions

What is the IUPAC name of N-(cyclopentylmethyl)-2-[4-(methoxymethyl)piperidin-1-yl]ethanamine?
The IUPAC name of N-(cyclopentylmethyl)-2-[4-(methoxymethyl)piperidin-1-yl]ethanamine (CID 63979713) is N-(cyclopentylmethyl)-2-[4-(methoxymethyl)piperidin-1-yl]ethanamine.
What is the SMILES notation for N-(cyclopentylmethyl)-2-[4-(methoxymethyl)piperidin-1-yl]ethanamine?
The canonical SMILES for N-(cyclopentylmethyl)-2-[4-(methoxymethyl)piperidin-1-yl]ethanamine is COCC1CCN(CCNCC2CCCC2)CC1.
What is the InChIKey of N-(cyclopentylmethyl)-2-[4-(methoxymethyl)piperidin-1-yl]ethanamine?
The InChIKey is GIMQZWPHTLJXRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O/c1-18-13-15-6-9-17(10-7-15)11-8-16-12-14-4-2-3-5-14/h14-16H,2-13H2,1H3.
What are the key properties of N-(cyclopentylmethyl)-2-[4-(methoxymethyl)piperidin-1-yl]ethanamine?
N-(cyclopentylmethyl)-2-[4-(methoxymethyl)piperidin-1-yl]ethanamine has a molecular weight of 254.42 g/mol, XLogP of 2.12, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopentylmethyl)-2-[4-(methoxymethyl)piperidin-1-yl]ethanamine is sourced from PubChem (CID 63979713), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).