N-(dicyclopropylmethyl)-2-(1-methylpiperidin-4-yl)ethanamine

C15H28N2 — CID 115717378

IUPACN-(dicyclopropylmethyl)-2-(1-methylpiperidin-4-yl)ethanamine
SMILESCN1CCC(CCNC(C2CC2)C2CC2)CC1
InChIInChI=1S/C15H28N2/c1-17-10-7-12(8-11-17)6-9-16-15(13-2-3-13)14-4-5-14/h12-16H,2-11H2,1H3
InChIKeyMPYOSAQRLOFEAD-UHFFFAOYSA-N
MW236.40 g/mol
LogP2.50
Rot. Bonds6

About N-(dicyclopropylmethyl)-2-(1-methylpiperidin-4-yl)ethanamine

N-(dicyclopropylmethyl)-2-(1-methylpiperidin-4-yl)ethanamine (PubChem CID 115717378) has the molecular formula C15H28N2 and a molecular weight of 236.40 g/mol. Its IUPAC name is N-(dicyclopropylmethyl)-2-(1-methylpiperidin-4-yl)ethanamine.

Molecular Properties

Compound NameN-(dicyclopropylmethyl)-2-(1-methylpiperidin-4-yl)ethanamine
PubChem CID115717378
Molecular FormulaC15H28N2
Molecular Weight236.40 g/mol
Exact Mass236.23
IUPAC NameN-(dicyclopropylmethyl)-2-(1-methylpiperidin-4-yl)ethanamine
SMILESCN1CCC(CCNC(C2CC2)C2CC2)CC1
InChIInChI=1S/C15H28N2/c1-17-10-7-12(8-11-17)6-9-16-15(13-2-3-13)14-4-5-14/h12-16H,2-11H2,1H3
InChIKeyMPYOSAQRLOFEAD-UHFFFAOYSA-N
XLogP2.50
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.40
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-cyclopropyl-2-methoxy-N-[2-(1-methylpiperidin-4-yl)ethyl]ethanamine
CID 115717505
1-(1-methylcyclopropyl)-N-[2-(1-methylpiperidin-4-yl)ethyl]ethanamine
CID 115717463
2-[2-(1-methylpiperidin-4-yl)ethylamino]propanoic acid
CID 114515260
1-methyl-4-[2-(4-propan-2-ylcyclohexyl)ethyl]piperidine
CID 178033502
2-methyl-N-[2-(1-methylpiperidin-4-yl)ethyl]propan-1-amine
CID 115876275
2-[2-(1-methylpiperidin-4-yl)ethylamino]butanamide
CID 114515518
ethyl 2-[2-(1-methylpiperidin-4-yl)ethylamino]propanoate
CID 114515449
N-[2-(1-methylpiperidin-4-yl)ethyl]octan-2-amine
CID 115717494
[2-(1-methylpiperidin-4-yl)ethylamino]methanol
CID 115229407
N-[2-(1-methylpiperidin-4-yl)ethyl]propan-1-amine
CID 114515255
2-[2-(1-methylpiperidin-4-yl)ethylamino]ethanethiol
CID 115224308
1-(azepan-1-yl)-2-[2-(1-methylpiperidin-4-yl)ethylamino]propan-1-one
CID 114515642

Frequently Asked Questions

What is the IUPAC name of N-(dicyclopropylmethyl)-2-(1-methylpiperidin-4-yl)ethanamine?
The IUPAC name of N-(dicyclopropylmethyl)-2-(1-methylpiperidin-4-yl)ethanamine (CID 115717378) is N-(dicyclopropylmethyl)-2-(1-methylpiperidin-4-yl)ethanamine.
What is the SMILES notation for N-(dicyclopropylmethyl)-2-(1-methylpiperidin-4-yl)ethanamine?
The canonical SMILES for N-(dicyclopropylmethyl)-2-(1-methylpiperidin-4-yl)ethanamine is CN1CCC(CCNC(C2CC2)C2CC2)CC1.
What is the InChIKey of N-(dicyclopropylmethyl)-2-(1-methylpiperidin-4-yl)ethanamine?
The InChIKey is MPYOSAQRLOFEAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2/c1-17-10-7-12(8-11-17)6-9-16-15(13-2-3-13)14-4-5-14/h12-16H,2-11H2,1H3.
What are the key properties of N-(dicyclopropylmethyl)-2-(1-methylpiperidin-4-yl)ethanamine?
N-(dicyclopropylmethyl)-2-(1-methylpiperidin-4-yl)ethanamine has a molecular weight of 236.40 g/mol, XLogP of 2.50, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(dicyclopropylmethyl)-2-(1-methylpiperidin-4-yl)ethanamine is sourced from PubChem (CID 115717378), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).