N-[3-(cyclopropylmethoxy)propyl]-1,2-dimethylpiperidin-4-amine

C14H28N2O — CID 81301163

IUPACN-[3-(cyclopropylmethoxy)propyl]-1,2-dimethylpiperidin-4-amine
SMILESCC1CC(NCCCOCC2CC2)CCN1C
InChIInChI=1S/C14H28N2O/c1-12-10-14(6-8-16(12)2)15-7-3-9-17-11-13-4-5-13/h12-15H,3-11H2,1-2H3
InChIKeyOFSXUOFVNNYPLX-UHFFFAOYSA-N
MW240.39 g/mol
LogP1.88
Rot. Bonds7

About N-[3-(cyclopropylmethoxy)propyl]-1,2-dimethylpiperidin-4-amine

N-[3-(cyclopropylmethoxy)propyl]-1,2-dimethylpiperidin-4-amine (PubChem CID 81301163) has the molecular formula C14H28N2O and a molecular weight of 240.39 g/mol. Its IUPAC name is N-[3-(cyclopropylmethoxy)propyl]-1,2-dimethylpiperidin-4-amine.

Molecular Properties

Compound NameN-[3-(cyclopropylmethoxy)propyl]-1,2-dimethylpiperidin-4-amine
PubChem CID81301163
Molecular FormulaC14H28N2O
Molecular Weight240.39 g/mol
Exact Mass240.22
IUPAC NameN-[3-(cyclopropylmethoxy)propyl]-1,2-dimethylpiperidin-4-amine
SMILESCC1CC(NCCCOCC2CC2)CCN1C
InChIInChI=1S/C14H28N2O/c1-12-10-14(6-8-16(12)2)15-7-3-9-17-11-13-4-5-13/h12-15H,3-11H2,1-2H3
InChIKeyOFSXUOFVNNYPLX-UHFFFAOYSA-N
XLogP1.88
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.39
LogP ≤ 51.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

1,2-dimethyl-N-(3-propan-2-yloxypropyl)piperidin-4-amine
CID 81302152
1-(cyclopropylmethoxy)-3-[(1,2-dimethylpiperidin-4-yl)amino]propan-2-ol
CID 81334318
N-[3-(cyclopropylmethoxy)propyl]-1-ethylpiperidin-4-amine
CID 28718720
N-[2-[2-(dimethylamino)ethoxy]ethyl]-1,2-dimethylpiperidin-4-amine
CID 107094111
1-N-[3-(cyclopropylmethoxy)propyl]cyclobutane-1,3-diamine
CID 80559624
N-(3,3-dimethylbutyl)-1,2-dimethylpiperidin-4-amine
CID 81332844
1-cyclopropyl-N-[3-(cyclopropylmethoxy)propyl]pyrrolidin-3-amine
CID 62980928
N-[3-(cyclopropylmethoxy)propyl]-4-ethylcyclohexan-1-amine
CID 28718710
1,2-dimethyl-N-(2-methylsulfonylethyl)piperidin-4-amine
CID 81332995
N-[3-(cyclopropylmethoxy)propyl]-3,3,5-trimethylcyclohexan-1-amine
CID 43081894
N-[3-(cyclopropylmethoxy)propyl]-4-propan-2-ylcyclohexan-1-amine
CID 62703150
1,2-dimethyl-N-[2-(3-methylphenoxy)ethyl]piperidin-4-amine
CID 81334394

Frequently Asked Questions

What is the IUPAC name of N-[3-(cyclopropylmethoxy)propyl]-1,2-dimethylpiperidin-4-amine?
The IUPAC name of N-[3-(cyclopropylmethoxy)propyl]-1,2-dimethylpiperidin-4-amine (CID 81301163) is N-[3-(cyclopropylmethoxy)propyl]-1,2-dimethylpiperidin-4-amine.
What is the SMILES notation for N-[3-(cyclopropylmethoxy)propyl]-1,2-dimethylpiperidin-4-amine?
The canonical SMILES for N-[3-(cyclopropylmethoxy)propyl]-1,2-dimethylpiperidin-4-amine is CC1CC(NCCCOCC2CC2)CCN1C.
What is the InChIKey of N-[3-(cyclopropylmethoxy)propyl]-1,2-dimethylpiperidin-4-amine?
The InChIKey is OFSXUOFVNNYPLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O/c1-12-10-14(6-8-16(12)2)15-7-3-9-17-11-13-4-5-13/h12-15H,3-11H2,1-2H3.
What are the key properties of N-[3-(cyclopropylmethoxy)propyl]-1,2-dimethylpiperidin-4-amine?
N-[3-(cyclopropylmethoxy)propyl]-1,2-dimethylpiperidin-4-amine has a molecular weight of 240.39 g/mol, XLogP of 1.88, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(cyclopropylmethoxy)propyl]-1,2-dimethylpiperidin-4-amine is sourced from PubChem (CID 81301163), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).