N-(2-methylpropyl)-2-[2-[1-(propylamino)ethyl]piperidin-1-yl]acetamide

C16H33N3O — CID 63854873

IUPACN-(2-methylpropyl)-2-[2-[1-(propylamino)ethyl]piperidin-1-yl]acetamide
SMILESCCCNC(C)C1CCCCN1CC(=O)NCC(C)C
InChIInChI=1S/C16H33N3O/c1-5-9-17-14(4)15-8-6-7-10-19(15)12-16(20)18-11-13(2)3/h13-15,17H,5-12H2,1-4H3,(H,18,20)
InChIKeyJGIXACFCRNSXCV-UHFFFAOYSA-N
MW283.46 g/mol
LogP2.00
Rot. Bonds8

About N-(2-methylpropyl)-2-[2-[1-(propylamino)ethyl]piperidin-1-yl]acetamide

N-(2-methylpropyl)-2-[2-[1-(propylamino)ethyl]piperidin-1-yl]acetamide (PubChem CID 63854873) has the molecular formula C16H33N3O and a molecular weight of 283.46 g/mol. Its IUPAC name is N-(2-methylpropyl)-2-[2-[1-(propylamino)ethyl]piperidin-1-yl]acetamide.

Molecular Properties

Compound NameN-(2-methylpropyl)-2-[2-[1-(propylamino)ethyl]piperidin-1-yl]acetamide
PubChem CID63854873
Molecular FormulaC16H33N3O
Molecular Weight283.46 g/mol
Exact Mass283.26
IUPAC NameN-(2-methylpropyl)-2-[2-[1-(propylamino)ethyl]piperidin-1-yl]acetamide
SMILESCCCNC(C)C1CCCCN1CC(=O)NCC(C)C
InChIInChI=1S/C16H33N3O/c1-5-9-17-14(4)15-8-6-7-10-19(15)12-16(20)18-11-13(2)3/h13-15,17H,5-12H2,1-4H3,(H,18,20)
InChIKeyJGIXACFCRNSXCV-UHFFFAOYSA-N
XLogP2.00
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.46
LogP ≤ 52.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[2-(1-hydroxyethyl)piperidin-1-yl]-N-propylacetamide
CID 111107007
N-[1-(1-hexylpiperidin-2-yl)ethyl]propan-1-amine
CID 63853121
N-[1-[1-(cyclopentylmethyl)piperidin-2-yl]ethyl]propan-1-amine
CID 63854878
1-[2-[1-(propylamino)ethyl]piperidin-1-yl]butan-2-ol
CID 63853660
2-[2-(1-aminoethyl)piperidin-1-yl]-N-butylacetamide
CID 63255648
N-[1-[1-(2-methylbutyl)piperidin-2-yl]ethyl]propan-1-amine
CID 55256667
2-[2-[1-(ethylamino)ethyl]piperidin-1-yl]-N-(oxan-4-yl)acetamide
CID 63855035
N-(2-methylpropyl)-2-[(2R)-2-(pyrrolidine-1-carbonyl)piperidin-1-yl]acetamide
CID 94778620
2-[(2S)-1-[2-(2-methylpropylamino)-2-oxoethyl]piperidin-2-yl]acetic acid
CID 93438414
N-propan-2-yl-2-[2-[1-(propylamino)ethyl]piperidin-1-yl]propanamide
CID 63852597
N-methyl-2-[2-[1-(propylamino)ethyl]piperidin-1-yl]propanamide
CID 63852599
methyl 2-[1-[2-(2-methylpropylamino)-2-oxoethyl]piperidin-2-yl]acetate
CID 61360608

Frequently Asked Questions

What is the IUPAC name of N-(2-methylpropyl)-2-[2-[1-(propylamino)ethyl]piperidin-1-yl]acetamide?
The IUPAC name of N-(2-methylpropyl)-2-[2-[1-(propylamino)ethyl]piperidin-1-yl]acetamide (CID 63854873) is N-(2-methylpropyl)-2-[2-[1-(propylamino)ethyl]piperidin-1-yl]acetamide.
What is the SMILES notation for N-(2-methylpropyl)-2-[2-[1-(propylamino)ethyl]piperidin-1-yl]acetamide?
The canonical SMILES for N-(2-methylpropyl)-2-[2-[1-(propylamino)ethyl]piperidin-1-yl]acetamide is CCCNC(C)C1CCCCN1CC(=O)NCC(C)C.
What is the InChIKey of N-(2-methylpropyl)-2-[2-[1-(propylamino)ethyl]piperidin-1-yl]acetamide?
The InChIKey is JGIXACFCRNSXCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H33N3O/c1-5-9-17-14(4)15-8-6-7-10-19(15)12-16(20)18-11-13(2)3/h13-15,17H,5-12H2,1-4H3,(H,18,20).
What are the key properties of N-(2-methylpropyl)-2-[2-[1-(propylamino)ethyl]piperidin-1-yl]acetamide?
N-(2-methylpropyl)-2-[2-[1-(propylamino)ethyl]piperidin-1-yl]acetamide has a molecular weight of 283.46 g/mol, XLogP of 2.00, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylpropyl)-2-[2-[1-(propylamino)ethyl]piperidin-1-yl]acetamide is sourced from PubChem (CID 63854873), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).