N-methyl-N-(pyrrolidin-3-ylmethyl)acetamide;hydrochloride

C8H17ClN2O — CID 129319655

IUPACN-methyl-N-(pyrrolidin-3-ylmethyl)acetamide;hydrochloride
SMILESCC(=O)N(C)CC1CCNC1.Cl
InChIInChI=1S/C8H16N2O.ClH/c1-7(11)10(2)6-8-3-4-9-5-8;/h8-9H,3-6H2,1-2H3;1H
InChIKeyPXWDWAOJTATFBC-UHFFFAOYSA-N
MW192.69 g/mol
LogP0.50
Rot. Bonds2

About N-methyl-N-(pyrrolidin-3-ylmethyl)acetamide;hydrochloride

N-methyl-N-(pyrrolidin-3-ylmethyl)acetamide;hydrochloride (PubChem CID 129319655) has the molecular formula C8H17ClN2O and a molecular weight of 192.69 g/mol. Its IUPAC name is N-methyl-N-(pyrrolidin-3-ylmethyl)acetamide;hydrochloride.

Molecular Properties

Compound NameN-methyl-N-(pyrrolidin-3-ylmethyl)acetamide;hydrochloride
PubChem CID129319655
Molecular FormulaC8H17ClN2O
Molecular Weight192.69 g/mol
Exact Mass192.10
IUPAC NameN-methyl-N-(pyrrolidin-3-ylmethyl)acetamide;hydrochloride
SMILESCC(=O)N(C)CC1CCNC1.Cl
InChIInChI=1S/C8H16N2O.ClH/c1-7(11)10(2)6-8-3-4-9-5-8;/h8-9H,3-6H2,1-2H3;1H
InChIKeyPXWDWAOJTATFBC-UHFFFAOYSA-N
XLogP0.50
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.69
LogP ≤ 50.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-methyl-N-(piperidin-4-ylmethyl)acetamide;hydrochloride
CID 118998343
N,N-dimethyl-1-pyrrolidin-3-ylmethanamine;dihydrochloride
CID 23145859
N-methyl-N-pyrrolidin-3-ylacetamide;dihydrochloride
CID 174958940
N-methyl-N-[(3S)-pyrrolidin-3-yl]acetamide;hydrochloride
CID 119011345
oxan-4-yl N-methyl-N-[[(3S)-pyrrolidin-3-yl]methyl]carbamate
CID 146799591
2-(dimethylamino)-N-methyl-N-(piperidin-3-ylmethyl)acetamide
CID 106627954
2-acetamido-N-methyl-N-(piperidin-3-ylmethyl)acetamide
CID 106628048
2-pyrrolidin-3-ylacetic acid;hydrochloride
CID 42614151
(Z)-N,2-dimethyl-N-(piperidin-3-ylmethyl)pent-2-enamide
CID 106627593
N-[(4-acetylcyclohexyl)methyl]-N-methylacetamide
CID 143959726
1-cyclobutyl-N-methyl-N-(pyrrolidin-3-ylmethyl)methanamine
CID 62860068
4-ethoxy-N-methyl-N-(pyrrolidin-3-ylmethyl)benzamide
CID 115272269

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(pyrrolidin-3-ylmethyl)acetamide;hydrochloride?
The IUPAC name of N-methyl-N-(pyrrolidin-3-ylmethyl)acetamide;hydrochloride (CID 129319655) is N-methyl-N-(pyrrolidin-3-ylmethyl)acetamide;hydrochloride.
What is the SMILES notation for N-methyl-N-(pyrrolidin-3-ylmethyl)acetamide;hydrochloride?
The canonical SMILES for N-methyl-N-(pyrrolidin-3-ylmethyl)acetamide;hydrochloride is CC(=O)N(C)CC1CCNC1.Cl.
What is the InChIKey of N-methyl-N-(pyrrolidin-3-ylmethyl)acetamide;hydrochloride?
The InChIKey is PXWDWAOJTATFBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2O.ClH/c1-7(11)10(2)6-8-3-4-9-5-8;/h8-9H,3-6H2,1-2H3;1H.
What are the key properties of N-methyl-N-(pyrrolidin-3-ylmethyl)acetamide;hydrochloride?
N-methyl-N-(pyrrolidin-3-ylmethyl)acetamide;hydrochloride has a molecular weight of 192.69 g/mol, XLogP of 0.50, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(pyrrolidin-3-ylmethyl)acetamide;hydrochloride is sourced from PubChem (CID 129319655), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).