N-ethyl-1-(2-pyrrolidin-1-ylethyl)piperidin-4-amine

C13H27N3 — CID 107910858

IUPACN-ethyl-1-(2-pyrrolidin-1-ylethyl)piperidin-4-amine
SMILESCCNC1CCN(CCN2CCCC2)CC1
InChIInChI=1S/C13H27N3/c1-2-14-13-5-9-16(10-6-13)12-11-15-7-3-4-8-15/h13-14H,2-12H2,1H3
InChIKeyMSVAVKDJYGDDTQ-UHFFFAOYSA-N
MW225.38 g/mol
LogP1.16
Rot. Bonds5

About N-ethyl-1-(2-pyrrolidin-1-ylethyl)piperidin-4-amine

N-ethyl-1-(2-pyrrolidin-1-ylethyl)piperidin-4-amine (PubChem CID 107910858) has the molecular formula C13H27N3 and a molecular weight of 225.38 g/mol. Its IUPAC name is N-ethyl-1-(2-pyrrolidin-1-ylethyl)piperidin-4-amine.

Molecular Properties

Compound NameN-ethyl-1-(2-pyrrolidin-1-ylethyl)piperidin-4-amine
PubChem CID107910858
Molecular FormulaC13H27N3
Molecular Weight225.38 g/mol
Exact Mass225.22
IUPAC NameN-ethyl-1-(2-pyrrolidin-1-ylethyl)piperidin-4-amine
SMILESCCNC1CCN(CCN2CCCC2)CC1
InChIInChI=1S/C13H27N3/c1-2-14-13-5-9-16(10-6-13)12-11-15-7-3-4-8-15/h13-14H,2-12H2,1H3
InChIKeyMSVAVKDJYGDDTQ-UHFFFAOYSA-N
XLogP1.16
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.38
LogP ≤ 51.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-butyl-N-ethylpiperidin-4-amine
CID 43314967
N-ethyl-1-pentylpiperidin-4-amine
CID 43315098
1-dodecyl-N-ethylpiperidin-4-amine
CID 63400728
N-ethyl-1-(2-ethylsulfonylethyl)piperidin-4-amine
CID 60820479
N-[2-(azepan-1-yl)ethyl]-1-ethylpiperidin-4-amine
CID 61240570
N-ethyl-1-(4,4,4-trifluorobutyl)piperidin-4-amine
CID 115512946
1-(3-butoxypropyl)-N-ethylpiperidin-4-amine
CID 113481126
N-ethyl-1-(7-methyloctyl)piperidin-4-amine
CID 114004129
N-ethyl-1-[3-(oxolan-2-yl)propyl]piperidin-4-amine
CID 65159145
N-(2-pyrrolidin-1-ylethyl)cyclopropanamine
CID 54773109
1-cyclopentyl-N-ethylpiperidin-4-amine
CID 43315368
N-ethyl-1-(3-methylbut-2-enyl)piperidin-4-amine
CID 43755150

Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-(2-pyrrolidin-1-ylethyl)piperidin-4-amine?
The IUPAC name of N-ethyl-1-(2-pyrrolidin-1-ylethyl)piperidin-4-amine (CID 107910858) is N-ethyl-1-(2-pyrrolidin-1-ylethyl)piperidin-4-amine.
What is the SMILES notation for N-ethyl-1-(2-pyrrolidin-1-ylethyl)piperidin-4-amine?
The canonical SMILES for N-ethyl-1-(2-pyrrolidin-1-ylethyl)piperidin-4-amine is CCNC1CCN(CCN2CCCC2)CC1.
What is the InChIKey of N-ethyl-1-(2-pyrrolidin-1-ylethyl)piperidin-4-amine?
The InChIKey is MSVAVKDJYGDDTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27N3/c1-2-14-13-5-9-16(10-6-13)12-11-15-7-3-4-8-15/h13-14H,2-12H2,1H3.
What are the key properties of N-ethyl-1-(2-pyrrolidin-1-ylethyl)piperidin-4-amine?
N-ethyl-1-(2-pyrrolidin-1-ylethyl)piperidin-4-amine has a molecular weight of 225.38 g/mol, XLogP of 1.16, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-(2-pyrrolidin-1-ylethyl)piperidin-4-amine is sourced from PubChem (CID 107910858), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).