1-benzyl-N-(2-morpholin-3-ylcyclopentyl)pyrrolidin-3-amine

C20H31N3O — CID 120914425

IUPAC1-benzyl-N-(2-morpholin-3-ylcyclopentyl)pyrrolidin-3-amine
SMILESc1ccc(CN2CCC(NC3CCCC3C3COCCN3)C2)cc1
InChIInChI=1S/C20H31N3O/c1-2-5-16(6-3-1)13-23-11-9-17(14-23)22-19-8-4-7-18(19)20-15-24-12-10-21-20/h1-3,5-6,17-22H,4,7-15H2
InChIKeyYEJUZUUZMXWXTA-UHFFFAOYSA-N
MW329.49 g/mol
LogP2.01
Rot. Bonds5

About 1-benzyl-N-(2-morpholin-3-ylcyclopentyl)pyrrolidin-3-amine

1-benzyl-N-(2-morpholin-3-ylcyclopentyl)pyrrolidin-3-amine (PubChem CID 120914425) has the molecular formula C20H31N3O and a molecular weight of 329.49 g/mol. Its IUPAC name is 1-benzyl-N-(2-morpholin-3-ylcyclopentyl)pyrrolidin-3-amine.

Molecular Properties

Compound Name1-benzyl-N-(2-morpholin-3-ylcyclopentyl)pyrrolidin-3-amine
PubChem CID120914425
Molecular FormulaC20H31N3O
Molecular Weight329.49 g/mol
Exact Mass329.25
IUPAC Name1-benzyl-N-(2-morpholin-3-ylcyclopentyl)pyrrolidin-3-amine
SMILESc1ccc(CN2CCC(NC3CCCC3C3COCCN3)C2)cc1
InChIInChI=1S/C20H31N3O/c1-2-5-16(6-3-1)13-23-11-9-17(14-23)22-19-8-4-7-18(19)20-15-24-12-10-21-20/h1-3,5-6,17-22H,4,7-15H2
InChIKeyYEJUZUUZMXWXTA-UHFFFAOYSA-N
XLogP2.01
TPSA36.53 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.49
LogP ≤ 52.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-[(2,6-difluorophenyl)methyl]-N-(2-morpholin-3-ylcyclopentyl)piperidin-3-amine;hydrochloride
CID 120915896
N-(2-morpholin-3-ylcyclopentyl)-1-propylpiperidin-4-amine
CID 120914713
N-[[2-(azepan-1-ylmethyl)phenyl]methyl]-2-morpholin-3-ylcyclopentan-1-amine
CID 120913965
N-(2-morpholin-3-ylcyclopentyl)-1-pyridin-2-ylpiperidin-4-amine;hydrochloride
CID 120915468
1-[2-(difluoromethoxy)phenyl]-N-(2-morpholin-3-ylcyclopentyl)pyrrolidin-3-amine;hydrochloride
CID 120914520
1-methyl-N-(2-morpholin-3-ylcyclopentyl)piperidin-4-amine;hydrochloride
CID 120914710
N-[[3-[(4-methylpiperidin-1-yl)methyl]phenyl]methyl]-2-morpholin-3-ylcyclopentan-1-amine;hydrochloride
CID 120914320
[2-[(1-benzylpyrrolidin-3-yl)amino]cyclopentyl]methanol
CID 103709861
N-methyl-2-[4-[(2-morpholin-3-ylcyclopentyl)amino]piperidin-1-yl]acetamide
CID 120915273
1-(4-tert-butylphenyl)-N-(2-morpholin-3-ylcyclopentyl)piperidin-4-amine
CID 120914461
N-[[4-[(3,5-dimethylpiperidin-1-yl)methyl]phenyl]methyl]-2-morpholin-3-ylcyclopentan-1-amine;hydrochloride
CID 120915590
1-benzyl-N-(oxolan-3-yl)piperidin-3-amine
CID 64590674

Frequently Asked Questions

What is the IUPAC name of 1-benzyl-N-(2-morpholin-3-ylcyclopentyl)pyrrolidin-3-amine?
The IUPAC name of 1-benzyl-N-(2-morpholin-3-ylcyclopentyl)pyrrolidin-3-amine (CID 120914425) is 1-benzyl-N-(2-morpholin-3-ylcyclopentyl)pyrrolidin-3-amine.
What is the SMILES notation for 1-benzyl-N-(2-morpholin-3-ylcyclopentyl)pyrrolidin-3-amine?
The canonical SMILES for 1-benzyl-N-(2-morpholin-3-ylcyclopentyl)pyrrolidin-3-amine is c1ccc(CN2CCC(NC3CCCC3C3COCCN3)C2)cc1.
What is the InChIKey of 1-benzyl-N-(2-morpholin-3-ylcyclopentyl)pyrrolidin-3-amine?
The InChIKey is YEJUZUUZMXWXTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H31N3O/c1-2-5-16(6-3-1)13-23-11-9-17(14-23)22-19-8-4-7-18(19)20-15-24-12-10-21-20/h1-3,5-6,17-22H,4,7-15H2.
What are the key properties of 1-benzyl-N-(2-morpholin-3-ylcyclopentyl)pyrrolidin-3-amine?
1-benzyl-N-(2-morpholin-3-ylcyclopentyl)pyrrolidin-3-amine has a molecular weight of 329.49 g/mol, XLogP of 2.01, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzyl-N-(2-morpholin-3-ylcyclopentyl)pyrrolidin-3-amine is sourced from PubChem (CID 120914425), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).