1-cyclopropyl-N-(3,4-dihydro-2H-pyran-2-ylmethyl)piperidin-4-amine

C14H24N2O — CID 62064402

IUPAC1-cyclopropyl-N-(3,4-dihydro-2H-pyran-2-ylmethyl)piperidin-4-amine
SMILESC1=COC(CNC2CCN(C3CC3)CC2)CC1
InChIInChI=1S/C14H24N2O/c1-2-10-17-14(3-1)11-15-12-6-8-16(9-7-12)13-4-5-13/h2,10,12-15H,1,3-9,11H2
InChIKeySHPMZEKFWVCFMB-UHFFFAOYSA-N
MW236.36 g/mol
LogP1.90
Rot. Bonds4

About 1-cyclopropyl-N-(3,4-dihydro-2H-pyran-2-ylmethyl)piperidin-4-amine

1-cyclopropyl-N-(3,4-dihydro-2H-pyran-2-ylmethyl)piperidin-4-amine (PubChem CID 62064402) has the molecular formula C14H24N2O and a molecular weight of 236.36 g/mol. Its IUPAC name is 1-cyclopropyl-N-(3,4-dihydro-2H-pyran-2-ylmethyl)piperidin-4-amine.

Molecular Properties

Compound Name1-cyclopropyl-N-(3,4-dihydro-2H-pyran-2-ylmethyl)piperidin-4-amine
PubChem CID62064402
Molecular FormulaC14H24N2O
Molecular Weight236.36 g/mol
Exact Mass236.19
IUPAC Name1-cyclopropyl-N-(3,4-dihydro-2H-pyran-2-ylmethyl)piperidin-4-amine
SMILESC1=COC(CNC2CCN(C3CC3)CC2)CC1
InChIInChI=1S/C14H24N2O/c1-2-10-17-14(3-1)11-15-12-6-8-16(9-7-12)13-4-5-13/h2,10,12-15H,1,3-9,11H2
InChIKeySHPMZEKFWVCFMB-UHFFFAOYSA-N
XLogP1.90
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.36
LogP ≤ 51.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-cyclopropyl-N-(3,4-dihydro-2H-pyran-2-ylmethyl)piperidin-4-amine with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-N-(3,4-dihydro-2H-pyran-2-ylmethyl)piperidin-4-amine?
The IUPAC name of 1-cyclopropyl-N-(3,4-dihydro-2H-pyran-2-ylmethyl)piperidin-4-amine (CID 62064402) is 1-cyclopropyl-N-(3,4-dihydro-2H-pyran-2-ylmethyl)piperidin-4-amine.
What is the SMILES notation for 1-cyclopropyl-N-(3,4-dihydro-2H-pyran-2-ylmethyl)piperidin-4-amine?
The canonical SMILES for 1-cyclopropyl-N-(3,4-dihydro-2H-pyran-2-ylmethyl)piperidin-4-amine is C1=COC(CNC2CCN(C3CC3)CC2)CC1.
What is the InChIKey of 1-cyclopropyl-N-(3,4-dihydro-2H-pyran-2-ylmethyl)piperidin-4-amine?
The InChIKey is SHPMZEKFWVCFMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O/c1-2-10-17-14(3-1)11-15-12-6-8-16(9-7-12)13-4-5-13/h2,10,12-15H,1,3-9,11H2.
What are the key properties of 1-cyclopropyl-N-(3,4-dihydro-2H-pyran-2-ylmethyl)piperidin-4-amine?
1-cyclopropyl-N-(3,4-dihydro-2H-pyran-2-ylmethyl)piperidin-4-amine has a molecular weight of 236.36 g/mol, XLogP of 1.90, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-N-(3,4-dihydro-2H-pyran-2-ylmethyl)piperidin-4-amine is sourced from PubChem (CID 62064402), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).