4-(aminomethyl)-N-ethyl-N-(1-methoxypropan-2-yl)-1-propylpiperidin-4-amine

C15H33N3O — CID 55010968

IUPAC4-(aminomethyl)-N-ethyl-N-(1-methoxypropan-2-yl)-1-propylpiperidin-4-amine
SMILESCCCN1CCC(CN)(N(CC)C(C)COC)CC1
InChIInChI=1S/C15H33N3O/c1-5-9-17-10-7-15(13-16,8-11-17)18(6-2)14(3)12-19-4/h14H,5-13,16H2,1-4H3
InChIKeyCSKSVEJVLCWJSV-UHFFFAOYSA-N
MW271.45 g/mol
LogP1.55
Rot. Bonds8

About 4-(aminomethyl)-N-ethyl-N-(1-methoxypropan-2-yl)-1-propylpiperidin-4-amine

4-(aminomethyl)-N-ethyl-N-(1-methoxypropan-2-yl)-1-propylpiperidin-4-amine (PubChem CID 55010968) has the molecular formula C15H33N3O and a molecular weight of 271.45 g/mol. Its IUPAC name is 4-(aminomethyl)-N-ethyl-N-(1-methoxypropan-2-yl)-1-propylpiperidin-4-amine.

Molecular Properties

Compound Name4-(aminomethyl)-N-ethyl-N-(1-methoxypropan-2-yl)-1-propylpiperidin-4-amine
PubChem CID55010968
Molecular FormulaC15H33N3O
Molecular Weight271.45 g/mol
Exact Mass271.26
IUPAC Name4-(aminomethyl)-N-ethyl-N-(1-methoxypropan-2-yl)-1-propylpiperidin-4-amine
SMILESCCCN1CCC(CN)(N(CC)C(C)COC)CC1
InChIInChI=1S/C15H33N3O/c1-5-9-17-10-7-15(13-16,8-11-17)18(6-2)14(3)12-19-4/h14H,5-13,16H2,1-4H3
InChIKeyCSKSVEJVLCWJSV-UHFFFAOYSA-N
XLogP1.55
TPSA41.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.45
LogP ≤ 51.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-(aminomethyl)-N,1-diethyl-N-(1-methoxypropan-2-yl)piperidin-4-amine
CID 55011698
3-(aminomethyl)-1-cyclopropyl-N-ethyl-N-(1-methoxypropan-2-yl)pyrrolidin-3-amine
CID 62976391
1-(aminomethyl)-N-ethyl-3-methoxy-N-(1-methoxypropan-2-yl)cyclobutan-1-amine
CID 106821943
1-(aminomethyl)-N-ethyl-N-(1-methoxypropan-2-yl)-3-methylcyclopentan-1-amine
CID 64502008
1-(aminomethyl)-3-ethoxy-N-ethyl-N-(1-methoxypropan-2-yl)cyclobutan-1-amine
CID 106821942
2-(aminomethyl)-N-ethyl-N-(1-methoxypropan-2-yl)-1,3-dihydroinden-2-amine
CID 55011209
1-(aminomethyl)-N-ethyl-N-(1-methoxypropan-2-yl)-3-propan-2-ylcyclohexan-1-amine
CID 107449052
4-(aminomethyl)-1-ethyl-N-(2-methoxyethyl)-N-propan-2-ylazepan-4-amine
CID 82948086
4-(aminomethyl)-N-methyl-N-(2-methylpropyl)-1-propylazepan-4-amine
CID 65078460
3-(aminomethyl)-N,N-dimethyl-1-propylpyrrolidin-3-amine
CID 117012434
4-(aminomethyl)-N-(cyclopropylmethyl)-N-ethyl-1-propylpiperidin-4-amine
CID 63955749
1-(aminomethyl)-N-(1-methoxypropan-2-yl)-N-methyl-4-propan-2-ylcyclohexan-1-amine
CID 62704477

Frequently Asked Questions

What is the IUPAC name of 4-(aminomethyl)-N-ethyl-N-(1-methoxypropan-2-yl)-1-propylpiperidin-4-amine?
The IUPAC name of 4-(aminomethyl)-N-ethyl-N-(1-methoxypropan-2-yl)-1-propylpiperidin-4-amine (CID 55010968) is 4-(aminomethyl)-N-ethyl-N-(1-methoxypropan-2-yl)-1-propylpiperidin-4-amine.
What is the SMILES notation for 4-(aminomethyl)-N-ethyl-N-(1-methoxypropan-2-yl)-1-propylpiperidin-4-amine?
The canonical SMILES for 4-(aminomethyl)-N-ethyl-N-(1-methoxypropan-2-yl)-1-propylpiperidin-4-amine is CCCN1CCC(CN)(N(CC)C(C)COC)CC1.
What is the InChIKey of 4-(aminomethyl)-N-ethyl-N-(1-methoxypropan-2-yl)-1-propylpiperidin-4-amine?
The InChIKey is CSKSVEJVLCWJSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H33N3O/c1-5-9-17-10-7-15(13-16,8-11-17)18(6-2)14(3)12-19-4/h14H,5-13,16H2,1-4H3.
What are the key properties of 4-(aminomethyl)-N-ethyl-N-(1-methoxypropan-2-yl)-1-propylpiperidin-4-amine?
4-(aminomethyl)-N-ethyl-N-(1-methoxypropan-2-yl)-1-propylpiperidin-4-amine has a molecular weight of 271.45 g/mol, XLogP of 1.55, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(aminomethyl)-N-ethyl-N-(1-methoxypropan-2-yl)-1-propylpiperidin-4-amine is sourced from PubChem (CID 55010968), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).