1-[[1-(aminomethyl)cyclopentyl]methyl]-5-[(dimethylamino)methyl]pyrrolidin-3-ol

C14H29N3O — CID 66053698

IUPAC1-[[1-(aminomethyl)cyclopentyl]methyl]-5-[(dimethylamino)methyl]pyrrolidin-3-ol
SMILESCN(C)CC1CC(O)CN1CC1(CN)CCCC1
InChIInChI=1S/C14H29N3O/c1-16(2)8-12-7-13(18)9-17(12)11-14(10-15)5-3-4-6-14/h12-13,18H,3-11,15H2,1-2H3
InChIKeyHNEHJGPWCYSBMC-UHFFFAOYSA-N
MW255.41 g/mol
LogP0.50
Rot. Bonds5

About 1-[[1-(aminomethyl)cyclopentyl]methyl]-5-[(dimethylamino)methyl]pyrrolidin-3-ol

1-[[1-(aminomethyl)cyclopentyl]methyl]-5-[(dimethylamino)methyl]pyrrolidin-3-ol (PubChem CID 66053698) has the molecular formula C14H29N3O and a molecular weight of 255.41 g/mol. Its IUPAC name is 1-[[1-(aminomethyl)cyclopentyl]methyl]-5-[(dimethylamino)methyl]pyrrolidin-3-ol.

Molecular Properties

Compound Name1-[[1-(aminomethyl)cyclopentyl]methyl]-5-[(dimethylamino)methyl]pyrrolidin-3-ol
PubChem CID66053698
Molecular FormulaC14H29N3O
Molecular Weight255.41 g/mol
Exact Mass255.23
IUPAC Name1-[[1-(aminomethyl)cyclopentyl]methyl]-5-[(dimethylamino)methyl]pyrrolidin-3-ol
SMILESCN(C)CC1CC(O)CN1CC1(CN)CCCC1
InChIInChI=1S/C14H29N3O/c1-16(2)8-12-7-13(18)9-17(12)11-14(10-15)5-3-4-6-14/h12-13,18H,3-11,15H2,1-2H3
InChIKeyHNEHJGPWCYSBMC-UHFFFAOYSA-N
XLogP0.50
TPSA52.73 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 ≤ 50.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 1-[[1-(aminomethyl)cyclopentyl]methyl]-5-[(dimethylamino)methyl]pyrrolidin-3-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-[[1-(aminomethyl)cyclohexyl]methyl]-5-[(dimethylamino)methyl]pyrrolidin-3-ol
CID 66053118
5-[(dimethylamino)methyl]-1-[[1-(methylaminomethyl)cyclohexyl]methyl]pyrrolidin-3-ol
CID 66053309
5-[(dimethylamino)methyl]-1-[[4-(hydroxymethyl)oxan-4-yl]methyl]pyrrolidin-3-ol
CID 66052349
1-[1-[[1-(aminomethyl)cyclohexyl]methyl]pyrrolidin-2-yl]-N,N-dimethylmethanamine
CID 62890070
5-[(dimethylamino)methyl]-1-[[3-methyl-1-(methylaminomethyl)cyclohexyl]methyl]pyrrolidin-3-ol
CID 66052929
1-[1-[[1-(aminomethyl)cyclobutyl]methyl]pyrrolidin-2-yl]-N,N-dimethylmethanamine
CID 115449022
1-(3-amino-2-hydroxypropyl)-5-[(dimethylamino)methyl]pyrrolidin-3-ol
CID 104643439
1-[[1-(aminomethyl)cyclopentyl]methyl]azetidin-3-ol
CID 130878081
1-but-2-ynyl-5-[(dimethylamino)methyl]pyrrolidin-3-ol
CID 66053040
1-(2-bromoprop-2-enyl)-5-[(dimethylamino)methyl]pyrrolidin-3-ol
CID 66054174
potassium [2-[(dimethylamino)methyl]-4-hydroxypyrrolidin-1-yl]methyl-trifluoroboranuide
CID 66052358
1-but-3-ynyl-5-[(dimethylamino)methyl]pyrrolidin-3-ol
CID 66056646

Frequently Asked Questions

What is the IUPAC name of 1-[[1-(aminomethyl)cyclopentyl]methyl]-5-[(dimethylamino)methyl]pyrrolidin-3-ol?
The IUPAC name of 1-[[1-(aminomethyl)cyclopentyl]methyl]-5-[(dimethylamino)methyl]pyrrolidin-3-ol (CID 66053698) is 1-[[1-(aminomethyl)cyclopentyl]methyl]-5-[(dimethylamino)methyl]pyrrolidin-3-ol.
What is the SMILES notation for 1-[[1-(aminomethyl)cyclopentyl]methyl]-5-[(dimethylamino)methyl]pyrrolidin-3-ol?
The canonical SMILES for 1-[[1-(aminomethyl)cyclopentyl]methyl]-5-[(dimethylamino)methyl]pyrrolidin-3-ol is CN(C)CC1CC(O)CN1CC1(CN)CCCC1.
What is the InChIKey of 1-[[1-(aminomethyl)cyclopentyl]methyl]-5-[(dimethylamino)methyl]pyrrolidin-3-ol?
The InChIKey is HNEHJGPWCYSBMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29N3O/c1-16(2)8-12-7-13(18)9-17(12)11-14(10-15)5-3-4-6-14/h12-13,18H,3-11,15H2,1-2H3.
What are the key properties of 1-[[1-(aminomethyl)cyclopentyl]methyl]-5-[(dimethylamino)methyl]pyrrolidin-3-ol?
1-[[1-(aminomethyl)cyclopentyl]methyl]-5-[(dimethylamino)methyl]pyrrolidin-3-ol has a molecular weight of 255.41 g/mol, XLogP of 0.50, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[1-(aminomethyl)cyclopentyl]methyl]-5-[(dimethylamino)methyl]pyrrolidin-3-ol is sourced from PubChem (CID 66053698), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).