1-[(1,4-dimethylpiperidin-4-yl)methyl]-N-propylpiperidin-4-amine

C16H33N3 — CID 107164155

IUPAC1-[(1,4-dimethylpiperidin-4-yl)methyl]-N-propylpiperidin-4-amine
SMILESCCCNC1CCN(CC2(C)CCN(C)CC2)CC1
InChIInChI=1S/C16H33N3/c1-4-9-17-15-5-10-19(11-6-15)14-16(2)7-12-18(3)13-8-16/h15,17H,4-14H2,1-3H3
InChIKeyBZGMYOYEBNHAIT-UHFFFAOYSA-N
MW267.46 g/mol
LogP2.18
Rot. Bonds5

About 1-[(1,4-dimethylpiperidin-4-yl)methyl]-N-propylpiperidin-4-amine

1-[(1,4-dimethylpiperidin-4-yl)methyl]-N-propylpiperidin-4-amine (PubChem CID 107164155) has the molecular formula C16H33N3 and a molecular weight of 267.46 g/mol. Its IUPAC name is 1-[(1,4-dimethylpiperidin-4-yl)methyl]-N-propylpiperidin-4-amine.

Molecular Properties

Compound Name1-[(1,4-dimethylpiperidin-4-yl)methyl]-N-propylpiperidin-4-amine
PubChem CID107164155
Molecular FormulaC16H33N3
Molecular Weight267.46 g/mol
Exact Mass267.27
IUPAC Name1-[(1,4-dimethylpiperidin-4-yl)methyl]-N-propylpiperidin-4-amine
SMILESCCCNC1CCN(CC2(C)CCN(C)CC2)CC1
InChIInChI=1S/C16H33N3/c1-4-9-17-15-5-10-19(11-6-15)14-16(2)7-12-18(3)13-8-16/h15,17H,4-14H2,1-3H3
InChIKeyBZGMYOYEBNHAIT-UHFFFAOYSA-N
XLogP2.18
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.46
LogP ≤ 52.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[(1-propan-2-ylcyclopropyl)methyl]-N-propylpiperidin-4-amine
CID 114113900
2-[4-(propylamino)piperidin-1-yl]ethanol
CID 60818603
1-[(1,4-dimethylpiperidin-4-yl)methyl]-5-methyl-1,4-diazepane
CID 107165073
N-[(1-methylcyclopentyl)methyl]-1-propylpiperidin-4-amine
CID 63822212
1-(4-methylpiperazin-1-yl)-2-[4-(propylamino)piperidin-1-yl]ethanone
CID 60818597
(3R)-1-methyl-N-propylpyrrolidin-3-amine
CID 93285609
1-(2-cyclopentylethyl)-N-propylpiperidin-4-amine
CID 54932891
1-[(1,4-dimethylpiperidin-4-yl)methyl]-N-ethyl-2-methylpiperidin-4-amine
CID 107164166
2-(4-methylpiperazin-1-yl)-1-[4-(propylamino)piperidin-1-yl]ethanone
CID 170861389
1-(oxan-4-yl)-N-propylpiperidin-4-amine
CID 43610262
1-(2-methylbutyl)-N-propylpiperidin-4-amine
CID 62105656
1-(2,2-dimethylbutyl)-N-propylpiperidin-4-amine
CID 103461877

Frequently Asked Questions

What is the IUPAC name of 1-[(1,4-dimethylpiperidin-4-yl)methyl]-N-propylpiperidin-4-amine?
The IUPAC name of 1-[(1,4-dimethylpiperidin-4-yl)methyl]-N-propylpiperidin-4-amine (CID 107164155) is 1-[(1,4-dimethylpiperidin-4-yl)methyl]-N-propylpiperidin-4-amine.
What is the SMILES notation for 1-[(1,4-dimethylpiperidin-4-yl)methyl]-N-propylpiperidin-4-amine?
The canonical SMILES for 1-[(1,4-dimethylpiperidin-4-yl)methyl]-N-propylpiperidin-4-amine is CCCNC1CCN(CC2(C)CCN(C)CC2)CC1.
What is the InChIKey of 1-[(1,4-dimethylpiperidin-4-yl)methyl]-N-propylpiperidin-4-amine?
The InChIKey is BZGMYOYEBNHAIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H33N3/c1-4-9-17-15-5-10-19(11-6-15)14-16(2)7-12-18(3)13-8-16/h15,17H,4-14H2,1-3H3.
What are the key properties of 1-[(1,4-dimethylpiperidin-4-yl)methyl]-N-propylpiperidin-4-amine?
1-[(1,4-dimethylpiperidin-4-yl)methyl]-N-propylpiperidin-4-amine has a molecular weight of 267.46 g/mol, XLogP of 2.18, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(1,4-dimethylpiperidin-4-yl)methyl]-N-propylpiperidin-4-amine is sourced from PubChem (CID 107164155), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).