2-(cyclopropylmethylamino)-N-[2-(4-methylpiperidin-1-yl)ethyl]acetamide;dihydrochloride

C14H29Cl2N3O — CID 119850882

IUPAC2-(cyclopropylmethylamino)-N-[2-(4-methylpiperidin-1-yl)ethyl]acetamide;dihydrochloride
SMILESCC1CCN(CCNC(=O)CNCC2CC2)CC1.Cl.Cl
InChIInChI=1S/C14H27N3O.2ClH/c1-12-4-7-17(8-5-12)9-6-16-14(18)11-15-10-13-2-3-13;;/h12-13,15H,2-11H2,1H3,(H,16,18);2*1H
InChIKeyMYEZAQFKMGGRIH-UHFFFAOYSA-N
MW326.31 g/mol
LogP1.68
Rot. Bonds7

About 2-(cyclopropylmethylamino)-N-[2-(4-methylpiperidin-1-yl)ethyl]acetamide;dihydrochloride

2-(cyclopropylmethylamino)-N-[2-(4-methylpiperidin-1-yl)ethyl]acetamide;dihydrochloride (PubChem CID 119850882) has the molecular formula C14H29Cl2N3O and a molecular weight of 326.31 g/mol. Its IUPAC name is 2-(cyclopropylmethylamino)-N-[2-(4-methylpiperidin-1-yl)ethyl]acetamide;dihydrochloride.

Molecular Properties

Compound Name2-(cyclopropylmethylamino)-N-[2-(4-methylpiperidin-1-yl)ethyl]acetamide;dihydrochloride
PubChem CID119850882
Molecular FormulaC14H29Cl2N3O
Molecular Weight326.31 g/mol
Exact Mass325.17
IUPAC Name2-(cyclopropylmethylamino)-N-[2-(4-methylpiperidin-1-yl)ethyl]acetamide;dihydrochloride
SMILESCC1CCN(CCNC(=O)CNCC2CC2)CC1.Cl.Cl
InChIInChI=1S/C14H27N3O.2ClH/c1-12-4-7-17(8-5-12)9-6-16-14(18)11-15-10-13-2-3-13;;/h12-13,15H,2-11H2,1H3,(H,16,18);2*1H
InChIKeyMYEZAQFKMGGRIH-UHFFFAOYSA-N
XLogP1.68
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.31
LogP ≤ 51.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(cyclopropylmethylamino)-N-(3-pyrrolidin-1-ylpropyl)acetamide;dihydrochloride
CID 119835575
2-(cyclopropylmethylamino)-N-[3-(4-methylpiperazin-1-yl)propyl]acetamide;trihydrochloride
CID 119901090
N-[2-(4-methylpiperidin-1-yl)ethyl]-2-[(2-methylpropan-2-yl)oxy]acetamide
CID 112605264
2-(cyclopropylmethylamino)-N-[[4-[(4-methylpiperidin-1-yl)methyl]phenyl]methyl]acetamide;dihydrochloride
CID 119845098
2-(cyclopropylmethylamino)-N-[(1-methylpiperidin-4-yl)methyl]acetamide;dihydrochloride
CID 119866901
2-bromo-N-[3-(4-methylpiperidin-1-yl)propyl]acetamide
CID 63679463
N-(2-acetamidoethyl)-2-(cyclopropylmethylamino)acetamide
CID 60867423
2-(4-methylpiperidin-1-yl)-N-(2-morpholin-4-ylethyl)acetamide
CID 108993688
2,2-difluoro-N-[2-(4-methylpiperidin-1-yl)ethyl]acetamide
CID 103515570
3,3-dimethyl-5-[2-(4-methylpiperidin-1-yl)ethylamino]-5-oxopentanoic acid
CID 62934088
2-(cyclopropylmethylamino)-N-[3-(4-methylpiperazin-1-yl)-3-oxopropyl]acetamide;dihydrochloride
CID 119849545
2-amino-N-[2-(4-methylpiperidin-1-yl)ethyl]propanamide
CID 61241466

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopropylmethylamino)-N-[2-(4-methylpiperidin-1-yl)ethyl]acetamide;dihydrochloride?
The IUPAC name of 2-(cyclopropylmethylamino)-N-[2-(4-methylpiperidin-1-yl)ethyl]acetamide;dihydrochloride (CID 119850882) is 2-(cyclopropylmethylamino)-N-[2-(4-methylpiperidin-1-yl)ethyl]acetamide;dihydrochloride.
What is the SMILES notation for 2-(cyclopropylmethylamino)-N-[2-(4-methylpiperidin-1-yl)ethyl]acetamide;dihydrochloride?
The canonical SMILES for 2-(cyclopropylmethylamino)-N-[2-(4-methylpiperidin-1-yl)ethyl]acetamide;dihydrochloride is CC1CCN(CCNC(=O)CNCC2CC2)CC1.Cl.Cl.
What is the InChIKey of 2-(cyclopropylmethylamino)-N-[2-(4-methylpiperidin-1-yl)ethyl]acetamide;dihydrochloride?
The InChIKey is MYEZAQFKMGGRIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N3O.2ClH/c1-12-4-7-17(8-5-12)9-6-16-14(18)11-15-10-13-2-3-13;;/h12-13,15H,2-11H2,1H3,(H,16,18);2*1H.
What are the key properties of 2-(cyclopropylmethylamino)-N-[2-(4-methylpiperidin-1-yl)ethyl]acetamide;dihydrochloride?
2-(cyclopropylmethylamino)-N-[2-(4-methylpiperidin-1-yl)ethyl]acetamide;dihydrochloride has a molecular weight of 326.31 g/mol, XLogP of 1.68, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopropylmethylamino)-N-[2-(4-methylpiperidin-1-yl)ethyl]acetamide;dihydrochloride is sourced from PubChem (CID 119850882), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).