N-methyl-N-propan-2-yl-2-[4-[(propan-2-ylamino)methyl]piperidin-1-yl]acetamide

C15H31N3O — CID 63848072

IUPACN-methyl-N-propan-2-yl-2-[4-[(propan-2-ylamino)methyl]piperidin-1-yl]acetamide
SMILESCC(C)NCC1CCN(CC(=O)N(C)C(C)C)CC1
InChIInChI=1S/C15H31N3O/c1-12(2)16-10-14-6-8-18(9-7-14)11-15(19)17(5)13(3)4/h12-14,16H,6-11H2,1-5H3
InChIKeyWNAQTGXRNAOVFJ-UHFFFAOYSA-N
MW269.43 g/mol
LogP1.56
Rot. Bonds6

About N-methyl-N-propan-2-yl-2-[4-[(propan-2-ylamino)methyl]piperidin-1-yl]acetamide

N-methyl-N-propan-2-yl-2-[4-[(propan-2-ylamino)methyl]piperidin-1-yl]acetamide (PubChem CID 63848072) has the molecular formula C15H31N3O and a molecular weight of 269.43 g/mol. Its IUPAC name is N-methyl-N-propan-2-yl-2-[4-[(propan-2-ylamino)methyl]piperidin-1-yl]acetamide.

Molecular Properties

Compound NameN-methyl-N-propan-2-yl-2-[4-[(propan-2-ylamino)methyl]piperidin-1-yl]acetamide
PubChem CID63848072
Molecular FormulaC15H31N3O
Molecular Weight269.43 g/mol
Exact Mass269.25
IUPAC NameN-methyl-N-propan-2-yl-2-[4-[(propan-2-ylamino)methyl]piperidin-1-yl]acetamide
SMILESCC(C)NCC1CCN(CC(=O)N(C)C(C)C)CC1
InChIInChI=1S/C15H31N3O/c1-12(2)16-10-14-6-8-18(9-7-14)11-15(19)17(5)13(3)4/h12-14,16H,6-11H2,1-5H3
InChIKeyWNAQTGXRNAOVFJ-UHFFFAOYSA-N
XLogP1.56
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.43
LogP ≤ 51.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-methyl-N-propan-2-yl-2-[4-[(propan-2-ylamino)methyl]piperidin-1-yl]acetamide?
The IUPAC name of N-methyl-N-propan-2-yl-2-[4-[(propan-2-ylamino)methyl]piperidin-1-yl]acetamide (CID 63848072) is N-methyl-N-propan-2-yl-2-[4-[(propan-2-ylamino)methyl]piperidin-1-yl]acetamide.
What is the SMILES notation for N-methyl-N-propan-2-yl-2-[4-[(propan-2-ylamino)methyl]piperidin-1-yl]acetamide?
The canonical SMILES for N-methyl-N-propan-2-yl-2-[4-[(propan-2-ylamino)methyl]piperidin-1-yl]acetamide is CC(C)NCC1CCN(CC(=O)N(C)C(C)C)CC1.
What is the InChIKey of N-methyl-N-propan-2-yl-2-[4-[(propan-2-ylamino)methyl]piperidin-1-yl]acetamide?
The InChIKey is WNAQTGXRNAOVFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31N3O/c1-12(2)16-10-14-6-8-18(9-7-14)11-15(19)17(5)13(3)4/h12-14,16H,6-11H2,1-5H3.
What are the key properties of N-methyl-N-propan-2-yl-2-[4-[(propan-2-ylamino)methyl]piperidin-1-yl]acetamide?
N-methyl-N-propan-2-yl-2-[4-[(propan-2-ylamino)methyl]piperidin-1-yl]acetamide has a molecular weight of 269.43 g/mol, XLogP of 1.56, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-propan-2-yl-2-[4-[(propan-2-ylamino)methyl]piperidin-1-yl]acetamide is sourced from PubChem (CID 63848072), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).