N-(piperidin-3-ylmethyl)-2-propan-2-yl-N-propyloxan-4-amine

C17H34N2O — CID 106625470

IUPACN-(piperidin-3-ylmethyl)-2-propan-2-yl-N-propyloxan-4-amine
SMILESCCCN(CC1CCCNC1)C1CCOC(C(C)C)C1
InChIInChI=1S/C17H34N2O/c1-4-9-19(13-15-6-5-8-18-12-15)16-7-10-20-17(11-16)14(2)3/h14-18H,4-13H2,1-3H3
InChIKeyVIKNWCBTGRFSKO-UHFFFAOYSA-N
MW282.47 g/mol
LogP2.90
Rot. Bonds6

About N-(piperidin-3-ylmethyl)-2-propan-2-yl-N-propyloxan-4-amine

N-(piperidin-3-ylmethyl)-2-propan-2-yl-N-propyloxan-4-amine (PubChem CID 106625470) has the molecular formula C17H34N2O and a molecular weight of 282.47 g/mol. Its IUPAC name is N-(piperidin-3-ylmethyl)-2-propan-2-yl-N-propyloxan-4-amine.

Molecular Properties

Compound NameN-(piperidin-3-ylmethyl)-2-propan-2-yl-N-propyloxan-4-amine
PubChem CID106625470
Molecular FormulaC17H34N2O
Molecular Weight282.47 g/mol
Exact Mass282.27
IUPAC NameN-(piperidin-3-ylmethyl)-2-propan-2-yl-N-propyloxan-4-amine
SMILESCCCN(CC1CCCNC1)C1CCOC(C(C)C)C1
InChIInChI=1S/C17H34N2O/c1-4-9-19(13-15-6-5-8-18-12-15)16-7-10-20-17(11-16)14(2)3/h14-18H,4-13H2,1-3H3
InChIKeyVIKNWCBTGRFSKO-UHFFFAOYSA-N
XLogP2.90
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.47
LogP ≤ 52.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(piperidin-3-ylmethyl)-N,2-dipropyloxan-4-amine
CID 106625371
3,5-dimethyl-N-(piperidin-3-ylmethyl)-N-propylcyclohexan-1-amine
CID 106625170
N-ethyl-N-(piperidin-3-ylmethyl)-3-propan-2-ylcyclohexan-1-amine
CID 107449593
N-(piperidin-3-ylmethyl)-N-propan-2-yl-2-propyloxan-4-amine
CID 106624199
N-hexyl-N-(piperidin-3-ylmethyl)cyclopropanamine
CID 106624769
N-ethyl-N-(piperidin-3-ylmethyl)-4-propan-2-ylcyclohexan-1-amine
CID 106624491
N-(oxolan-3-ylmethyl)-N-propylpiperidin-3-amine
CID 63638803
N-ethyl-N-(piperidin-2-ylmethyl)-2-propan-2-yloxan-4-amine
CID 106622747
2-ethyl-N-methyl-N-(piperidin-3-ylmethyl)oxan-4-amine
CID 106623629
N-(2-methylsulfanylethyl)-N-(piperidin-3-ylmethyl)cyclopropanamine
CID 106639574
N-cyclopropyl-N-(piperidin-4-ylmethyl)-2-propan-2-yloxan-4-amine
CID 79715647
N-(2-ethylsulfonylethyl)-N-(piperidin-3-ylmethyl)cyclopropanamine
CID 106640099

Frequently Asked Questions

What is the IUPAC name of N-(piperidin-3-ylmethyl)-2-propan-2-yl-N-propyloxan-4-amine?
The IUPAC name of N-(piperidin-3-ylmethyl)-2-propan-2-yl-N-propyloxan-4-amine (CID 106625470) is N-(piperidin-3-ylmethyl)-2-propan-2-yl-N-propyloxan-4-amine.
What is the SMILES notation for N-(piperidin-3-ylmethyl)-2-propan-2-yl-N-propyloxan-4-amine?
The canonical SMILES for N-(piperidin-3-ylmethyl)-2-propan-2-yl-N-propyloxan-4-amine is CCCN(CC1CCCNC1)C1CCOC(C(C)C)C1.
What is the InChIKey of N-(piperidin-3-ylmethyl)-2-propan-2-yl-N-propyloxan-4-amine?
The InChIKey is VIKNWCBTGRFSKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H34N2O/c1-4-9-19(13-15-6-5-8-18-12-15)16-7-10-20-17(11-16)14(2)3/h14-18H,4-13H2,1-3H3.
What are the key properties of N-(piperidin-3-ylmethyl)-2-propan-2-yl-N-propyloxan-4-amine?
N-(piperidin-3-ylmethyl)-2-propan-2-yl-N-propyloxan-4-amine has a molecular weight of 282.47 g/mol, XLogP of 2.90, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(piperidin-3-ylmethyl)-2-propan-2-yl-N-propyloxan-4-amine is sourced from PubChem (CID 106625470), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).