N-[(1-cyclopentylpiperidin-4-yl)methyl]oxan-3-amine

C16H30N2O — CID 131906608

IUPACN-[(1-cyclopentylpiperidin-4-yl)methyl]oxan-3-amine
SMILESC1COCC(NCC2CCN(C3CCCC3)CC2)C1
InChIInChI=1S/C16H30N2O/c1-2-6-16(5-1)18-9-7-14(8-10-18)12-17-15-4-3-11-19-13-15/h14-17H,1-13H2
InChIKeyWCDNZDNUABVJRD-UHFFFAOYSA-N
MW266.43 g/mol
LogP2.41
Rot. Bonds4

About N-[(1-cyclopentylpiperidin-4-yl)methyl]oxan-3-amine

N-[(1-cyclopentylpiperidin-4-yl)methyl]oxan-3-amine (PubChem CID 131906608) has the molecular formula C16H30N2O and a molecular weight of 266.43 g/mol. Its IUPAC name is N-[(1-cyclopentylpiperidin-4-yl)methyl]oxan-3-amine.

Molecular Properties

Compound NameN-[(1-cyclopentylpiperidin-4-yl)methyl]oxan-3-amine
PubChem CID131906608
Molecular FormulaC16H30N2O
Molecular Weight266.43 g/mol
Exact Mass266.24
IUPAC NameN-[(1-cyclopentylpiperidin-4-yl)methyl]oxan-3-amine
SMILESC1COCC(NCC2CCN(C3CCCC3)CC2)C1
InChIInChI=1S/C16H30N2O/c1-2-6-16(5-1)18-9-7-14(8-10-18)12-17-15-4-3-11-19-13-15/h14-17H,1-13H2
InChIKeyWCDNZDNUABVJRD-UHFFFAOYSA-N
XLogP2.41
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.43
LogP ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[(1-cyclopentylpiperidin-4-yl)methyl]oxan-3-amine 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-(2-morpholin-4-ylethyl)-1-(oxan-4-yl)ethanamine
CID 75443090
1-[(Oxan-4-yl)methyl]piperidin-4-amine
CID 53256375
N-[(4-fluoropiperidin-4-yl)methyl]oxan-3-amine
CID 105470252
N-[2-(1-cyclopentylpiperidin-4-yl)ethyl]-1-methoxypropan-2-amine
CID 50971002
4-(1-Piperidin-4-ylethyl)morpholine
CID 21059974
4-[2-(4-Piperidinylmethoxy)ethyl]morpholine
CID 26191013
4-[(1S)-1-piperidin-4-ylethyl]morpholine
CID 28063357
3-Methyl-4-(piperidin-4-ylmethyl)morpholine
CID 43542279
3-(Piperidin-4-yl)morpholine
CID 54191910
N-[(oxan-4-yl)methyl]piperidin-4-amine
CID 63726972
3-(1-Methylpiperidin-4-yl)morpholine
CID 82406441
4-Methyl-3-piperidin-4-ylmorpholine
CID 82406474

Frequently Asked Questions

What is the IUPAC name of N-[(1-cyclopentylpiperidin-4-yl)methyl]oxan-3-amine?
The IUPAC name of N-[(1-cyclopentylpiperidin-4-yl)methyl]oxan-3-amine (CID 131906608) is N-[(1-cyclopentylpiperidin-4-yl)methyl]oxan-3-amine.
What is the SMILES notation for N-[(1-cyclopentylpiperidin-4-yl)methyl]oxan-3-amine?
The canonical SMILES for N-[(1-cyclopentylpiperidin-4-yl)methyl]oxan-3-amine is C1COCC(NCC2CCN(C3CCCC3)CC2)C1.
What is the InChIKey of N-[(1-cyclopentylpiperidin-4-yl)methyl]oxan-3-amine?
The InChIKey is WCDNZDNUABVJRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30N2O/c1-2-6-16(5-1)18-9-7-14(8-10-18)12-17-15-4-3-11-19-13-15/h14-17H,1-13H2.
What are the key properties of N-[(1-cyclopentylpiperidin-4-yl)methyl]oxan-3-amine?
N-[(1-cyclopentylpiperidin-4-yl)methyl]oxan-3-amine has a molecular weight of 266.43 g/mol, XLogP of 2.41, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-cyclopentylpiperidin-4-yl)methyl]oxan-3-amine is sourced from PubChem (CID 131906608), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).