N,N-diethyl-1-[2-(ethylamino)cyclohexyl]pyrrolidin-3-amine

C16H33N3 — CID 63169941

IUPACN,N-diethyl-1-[2-(ethylamino)cyclohexyl]pyrrolidin-3-amine
SMILESCCNC1CCCCC1N1CCC(N(CC)CC)C1
InChIInChI=1S/C16H33N3/c1-4-17-15-9-7-8-10-16(15)19-12-11-14(13-19)18(5-2)6-3/h14-17H,4-13H2,1-3H3
InChIKeyDYBWOZZIYQBFEI-UHFFFAOYSA-N
MW267.46 g/mol
LogP2.32
Rot. Bonds6

About N,N-diethyl-1-[2-(ethylamino)cyclohexyl]pyrrolidin-3-amine

N,N-diethyl-1-[2-(ethylamino)cyclohexyl]pyrrolidin-3-amine (PubChem CID 63169941) has the molecular formula C16H33N3 and a molecular weight of 267.46 g/mol. Its IUPAC name is N,N-diethyl-1-[2-(ethylamino)cyclohexyl]pyrrolidin-3-amine.

Molecular Properties

Compound NameN,N-diethyl-1-[2-(ethylamino)cyclohexyl]pyrrolidin-3-amine
PubChem CID63169941
Molecular FormulaC16H33N3
Molecular Weight267.46 g/mol
Exact Mass267.27
IUPAC NameN,N-diethyl-1-[2-(ethylamino)cyclohexyl]pyrrolidin-3-amine
SMILESCCNC1CCCCC1N1CCC(N(CC)CC)C1
InChIInChI=1S/C16H33N3/c1-4-17-15-9-7-8-10-16(15)19-12-11-14(13-19)18(5-2)6-3/h14-17H,4-13H2,1-3H3
InChIKeyDYBWOZZIYQBFEI-UHFFFAOYSA-N
XLogP2.32
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.46
LogP ≤ 52.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-1-[2-(ethylamino)cyclohexyl]pyrrolidin-3-amine?
The IUPAC name of N,N-diethyl-1-[2-(ethylamino)cyclohexyl]pyrrolidin-3-amine (CID 63169941) is N,N-diethyl-1-[2-(ethylamino)cyclohexyl]pyrrolidin-3-amine.
What is the SMILES notation for N,N-diethyl-1-[2-(ethylamino)cyclohexyl]pyrrolidin-3-amine?
The canonical SMILES for N,N-diethyl-1-[2-(ethylamino)cyclohexyl]pyrrolidin-3-amine is CCNC1CCCCC1N1CCC(N(CC)CC)C1.
What is the InChIKey of N,N-diethyl-1-[2-(ethylamino)cyclohexyl]pyrrolidin-3-amine?
The InChIKey is DYBWOZZIYQBFEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H33N3/c1-4-17-15-9-7-8-10-16(15)19-12-11-14(13-19)18(5-2)6-3/h14-17H,4-13H2,1-3H3.
What are the key properties of N,N-diethyl-1-[2-(ethylamino)cyclohexyl]pyrrolidin-3-amine?
N,N-diethyl-1-[2-(ethylamino)cyclohexyl]pyrrolidin-3-amine has a molecular weight of 267.46 g/mol, XLogP of 2.32, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-1-[2-(ethylamino)cyclohexyl]pyrrolidin-3-amine is sourced from PubChem (CID 63169941), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).