N-[(5-methyloxolan-2-yl)methyl]-N-(piperidin-4-ylmethyl)cyclopropanamine

C15H28N2O — CID 82838195

IUPACN-[(5-methyloxolan-2-yl)methyl]-N-(piperidin-4-ylmethyl)cyclopropanamine
SMILESCC1CCC(CN(CC2CCNCC2)C2CC2)O1
InChIInChI=1S/C15H28N2O/c1-12-2-5-15(18-12)11-17(14-3-4-14)10-13-6-8-16-9-7-13/h12-16H,2-11H2,1H3
InChIKeyRGWHTIWMUQSKQV-UHFFFAOYSA-N
MW252.40 g/mol
LogP2.02
Rot. Bonds5

About N-[(5-methyloxolan-2-yl)methyl]-N-(piperidin-4-ylmethyl)cyclopropanamine

N-[(5-methyloxolan-2-yl)methyl]-N-(piperidin-4-ylmethyl)cyclopropanamine (PubChem CID 82838195) has the molecular formula C15H28N2O and a molecular weight of 252.40 g/mol. Its IUPAC name is N-[(5-methyloxolan-2-yl)methyl]-N-(piperidin-4-ylmethyl)cyclopropanamine.

Molecular Properties

Compound NameN-[(5-methyloxolan-2-yl)methyl]-N-(piperidin-4-ylmethyl)cyclopropanamine
PubChem CID82838195
Molecular FormulaC15H28N2O
Molecular Weight252.40 g/mol
Exact Mass252.22
IUPAC NameN-[(5-methyloxolan-2-yl)methyl]-N-(piperidin-4-ylmethyl)cyclopropanamine
SMILESCC1CCC(CN(CC2CCNCC2)C2CC2)O1
InChIInChI=1S/C15H28N2O/c1-12-2-5-15(18-12)11-17(14-3-4-14)10-13-6-8-16-9-7-13/h12-16H,2-11H2,1H3
InChIKeyRGWHTIWMUQSKQV-UHFFFAOYSA-N
XLogP2.02
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.40
LogP ≤ 52.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[(5-methyloxolan-2-yl)methyl]-N-(piperidin-4-ylmethyl)cyclopropanamine 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

N-[(5-methyloxolan-2-yl)methyl]-N-(piperidin-4-ylmethyl)ethanamine
CID 82837967
N-[[(2R,5R)-5-methyloxolan-2-yl]methyl]-N-[[(3R)-oxolan-3-yl]methyl]cyclopropanamine
CID 100620811
N-(2-chloroethyl)-N-[(5-methyloxolan-2-yl)methyl]cyclopropanamine
CID 103139756
N'-cyclopropyl-N,N-dimethyl-N'-(piperidin-4-ylmethyl)ethane-1,2-diamine
CID 79714194
N-ethyl-4-methyl-N-(piperidin-4-ylmethyl)cycloheptan-1-amine
CID 79715542
N-(2,2-dimethoxyethyl)-N-(piperidin-4-ylmethyl)cyclopropanamine
CID 81090110
methyl 2-[cyclopropyl(piperidin-4-ylmethyl)amino]acetate
CID 79714267
3-methyl-N-(piperidin-4-ylmethyl)-N-propylcyclopentan-1-amine
CID 79715188
N-ethyl-N-(piperidin-4-ylmethyl)-4-(trifluoromethyl)cyclohexan-1-amine
CID 79715457
N-ethyl-N-(pyrrolidin-3-ylmethyl)cyclopropanamine
CID 62372474
N-[(5-ethylfuran-2-yl)methyl]-N-(piperidin-4-ylmethyl)cyclopropanamine
CID 79715370
2-[cyclopropyl(piperidin-4-ylmethyl)amino]-N-ethyl-N-methylacetamide
CID 79714454

Frequently Asked Questions

What is the IUPAC name of N-[(5-methyloxolan-2-yl)methyl]-N-(piperidin-4-ylmethyl)cyclopropanamine?
The IUPAC name of N-[(5-methyloxolan-2-yl)methyl]-N-(piperidin-4-ylmethyl)cyclopropanamine (CID 82838195) is N-[(5-methyloxolan-2-yl)methyl]-N-(piperidin-4-ylmethyl)cyclopropanamine.
What is the SMILES notation for N-[(5-methyloxolan-2-yl)methyl]-N-(piperidin-4-ylmethyl)cyclopropanamine?
The canonical SMILES for N-[(5-methyloxolan-2-yl)methyl]-N-(piperidin-4-ylmethyl)cyclopropanamine is CC1CCC(CN(CC2CCNCC2)C2CC2)O1.
What is the InChIKey of N-[(5-methyloxolan-2-yl)methyl]-N-(piperidin-4-ylmethyl)cyclopropanamine?
The InChIKey is RGWHTIWMUQSKQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O/c1-12-2-5-15(18-12)11-17(14-3-4-14)10-13-6-8-16-9-7-13/h12-16H,2-11H2,1H3.
What are the key properties of N-[(5-methyloxolan-2-yl)methyl]-N-(piperidin-4-ylmethyl)cyclopropanamine?
N-[(5-methyloxolan-2-yl)methyl]-N-(piperidin-4-ylmethyl)cyclopropanamine has a molecular weight of 252.40 g/mol, XLogP of 2.02, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(5-methyloxolan-2-yl)methyl]-N-(piperidin-4-ylmethyl)cyclopropanamine is sourced from PubChem (CID 82838195), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).