[3-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]-1-(methylamino)cyclopentyl]methanol

C14H29N3O — CID 79656827

IUPAC[3-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]-1-(methylamino)cyclopentyl]methanol
SMILESCNC1(CO)CCC(N2CCCC2CN(C)C)C1
InChIInChI=1S/C14H29N3O/c1-15-14(11-18)7-6-12(9-14)17-8-4-5-13(17)10-16(2)3/h12-13,15,18H,4-11H2,1-3H3
InChIKeyJUUHGRSIWHEEHX-UHFFFAOYSA-N
MW255.41 g/mol
LogP0.52
Rot. Bonds5

About [3-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]-1-(methylamino)cyclopentyl]methanol

[3-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]-1-(methylamino)cyclopentyl]methanol (PubChem CID 79656827) has the molecular formula C14H29N3O and a molecular weight of 255.41 g/mol. Its IUPAC name is [3-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]-1-(methylamino)cyclopentyl]methanol.

Molecular Properties

Compound Name[3-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]-1-(methylamino)cyclopentyl]methanol
PubChem CID79656827
Molecular FormulaC14H29N3O
Molecular Weight255.41 g/mol
Exact Mass255.23
IUPAC Name[3-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]-1-(methylamino)cyclopentyl]methanol
SMILESCNC1(CO)CCC(N2CCCC2CN(C)C)C1
InChIInChI=1S/C14H29N3O/c1-15-14(11-18)7-6-12(9-14)17-8-4-5-13(17)10-16(2)3/h12-13,15,18H,4-11H2,1-3H3
InChIKeyJUUHGRSIWHEEHX-UHFFFAOYSA-N
XLogP0.52
TPSA38.74 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.41
LogP ≤ 50.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

[3-(2,3,4,4a,5,6,7,7a-octahydrocyclopenta[b]pyridin-1-yl)-1-(methylamino)cyclopentyl]methanol
CID 79656071
3-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]-1-(methylamino)cyclopentane-1-carbonitrile
CID 79639170
[1-(ethylamino)-3-(2-ethylpyrrolidin-1-yl)cyclopentyl]methanol
CID 79656929
1-amino-3-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]cyclopentane-1-carboxamide
CID 79650768
[3-(2,3,4,4a,5,6,7,7a-octahydrocyclopenta[b]pyridin-1-yl)-1-(methylamino)cyclohexyl]methanol
CID 79640172
[1-(cyclopropylamino)-3-(2-ethylpiperidin-1-yl)cyclopentyl]methanol
CID 79657108
3-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]-1-(ethylamino)cyclohexane-1-carbonitrile
CID 79625136
[1-(ethylamino)-3-(2-ethylpyrrolidin-1-yl)cyclohexyl]methanol
CID 79633807
[3-(3,4-dimethylpyrrolidin-1-yl)-1-(methylamino)cyclopentyl]methanol
CID 79646760
1-[1-(5,5-dimethylpyrrolidin-3-yl)pyrrolidin-2-yl]-N,N-dimethylmethanamine
CID 82015035
[3-(1-methyl-2,3,4,4a,5,7,8,8a-octahydro-1,6-naphthyridin-6-yl)-1-(methylamino)cyclopentyl]methanol
CID 81205829
[1-(methylamino)-3-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)cyclopentyl]methanol
CID 79644724

Frequently Asked Questions

What is the IUPAC name of [3-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]-1-(methylamino)cyclopentyl]methanol?
The IUPAC name of [3-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]-1-(methylamino)cyclopentyl]methanol (CID 79656827) is [3-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]-1-(methylamino)cyclopentyl]methanol.
What is the SMILES notation for [3-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]-1-(methylamino)cyclopentyl]methanol?
The canonical SMILES for [3-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]-1-(methylamino)cyclopentyl]methanol is CNC1(CO)CCC(N2CCCC2CN(C)C)C1.
What is the InChIKey of [3-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]-1-(methylamino)cyclopentyl]methanol?
The InChIKey is JUUHGRSIWHEEHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29N3O/c1-15-14(11-18)7-6-12(9-14)17-8-4-5-13(17)10-16(2)3/h12-13,15,18H,4-11H2,1-3H3.
What are the key properties of [3-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]-1-(methylamino)cyclopentyl]methanol?
[3-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]-1-(methylamino)cyclopentyl]methanol has a molecular weight of 255.41 g/mol, XLogP of 0.52, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [3-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]-1-(methylamino)cyclopentyl]methanol is sourced from PubChem (CID 79656827), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).