N-(2-morpholin-4-ylethyl)-1-pyrrolidin-2-ylpropan-2-amine

C13H27N3O — CID 79541011

IUPACN-(2-morpholin-4-ylethyl)-1-pyrrolidin-2-ylpropan-2-amine
SMILESCC(CC1CCCN1)NCCN1CCOCC1
InChIInChI=1S/C13H27N3O/c1-12(11-13-3-2-4-15-13)14-5-6-16-7-9-17-10-8-16/h12-15H,2-11H2,1H3
InChIKeyJWMSKWWCOBFVEX-UHFFFAOYSA-N
MW241.38 g/mol
LogP0.44
Rot. Bonds6

About N-(2-morpholin-4-ylethyl)-1-pyrrolidin-2-ylpropan-2-amine

N-(2-morpholin-4-ylethyl)-1-pyrrolidin-2-ylpropan-2-amine (PubChem CID 79541011) has the molecular formula C13H27N3O and a molecular weight of 241.38 g/mol. Its IUPAC name is N-(2-morpholin-4-ylethyl)-1-pyrrolidin-2-ylpropan-2-amine.

Molecular Properties

Compound NameN-(2-morpholin-4-ylethyl)-1-pyrrolidin-2-ylpropan-2-amine
PubChem CID79541011
Molecular FormulaC13H27N3O
Molecular Weight241.38 g/mol
Exact Mass241.22
IUPAC NameN-(2-morpholin-4-ylethyl)-1-pyrrolidin-2-ylpropan-2-amine
SMILESCC(CC1CCCN1)NCCN1CCOCC1
InChIInChI=1S/C13H27N3O/c1-12(11-13-3-2-4-15-13)14-5-6-16-7-9-17-10-8-16/h12-15H,2-11H2,1H3
InChIKeyJWMSKWWCOBFVEX-UHFFFAOYSA-N
XLogP0.44
TPSA36.53 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.38
LogP ≤ 50.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(4-methylpiperazin-1-yl)ethyl]-1-pyrrolidin-2-ylpropan-2-amine
CID 79539939
1-(azepan-2-yl)-N-[2-(azepan-1-yl)ethyl]propan-2-amine
CID 79560062
N-[3-(4-methylpiperazin-1-yl)propyl]-1-pyrrolidin-2-ylpropan-2-amine
CID 79541234
1-piperidin-2-yl-N-(3-pyrrolidin-1-ylpropyl)propan-2-amine
CID 79549233
N'-(1-pyrrolidin-2-ylpropan-2-yl)ethane-1,2-diamine
CID 79540795
1-morpholin-3-yl-N-(2-thiomorpholin-4-ylethyl)propan-2-amine
CID 114173708
N-(2-cyclopropylethyl)-1-pyrrolidin-2-ylpropan-2-amine
CID 79541627
N-(2-morpholin-4-ylethyl)-1-pyrrolidin-2-ylmethanesulfonamide
CID 54973648
4-methyl-N-(1-pyrrolidin-2-ylpropan-2-yl)pentan-1-amine
CID 79540929
3,3,3-trifluoro-N-(1-pyrrolidin-2-ylpropan-2-yl)propan-1-amine
CID 79539962
N',N'-di(propan-2-yl)-N-(1-pyrrolidin-2-ylpropan-2-yl)ethane-1,2-diamine
CID 79540106
3-(1-pyrrolidin-2-ylpropan-2-ylamino)propanoic acid
CID 79541025

Frequently Asked Questions

What is the IUPAC name of N-(2-morpholin-4-ylethyl)-1-pyrrolidin-2-ylpropan-2-amine?
The IUPAC name of N-(2-morpholin-4-ylethyl)-1-pyrrolidin-2-ylpropan-2-amine (CID 79541011) is N-(2-morpholin-4-ylethyl)-1-pyrrolidin-2-ylpropan-2-amine.
What is the SMILES notation for N-(2-morpholin-4-ylethyl)-1-pyrrolidin-2-ylpropan-2-amine?
The canonical SMILES for N-(2-morpholin-4-ylethyl)-1-pyrrolidin-2-ylpropan-2-amine is CC(CC1CCCN1)NCCN1CCOCC1.
What is the InChIKey of N-(2-morpholin-4-ylethyl)-1-pyrrolidin-2-ylpropan-2-amine?
The InChIKey is JWMSKWWCOBFVEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27N3O/c1-12(11-13-3-2-4-15-13)14-5-6-16-7-9-17-10-8-16/h12-15H,2-11H2,1H3.
What are the key properties of N-(2-morpholin-4-ylethyl)-1-pyrrolidin-2-ylpropan-2-amine?
N-(2-morpholin-4-ylethyl)-1-pyrrolidin-2-ylpropan-2-amine has a molecular weight of 241.38 g/mol, XLogP of 0.44, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-morpholin-4-ylethyl)-1-pyrrolidin-2-ylpropan-2-amine is sourced from PubChem (CID 79541011), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).