N-cyclopropyl-N-[2-(4-methylpiperazin-1-yl)ethyl]acetamide

C12H23N3O — CID 163456508

IUPACN-cyclopropyl-N-[2-(4-methylpiperazin-1-yl)ethyl]acetamide
SMILESCC(=O)N(CCN1CCN(C)CC1)C1CC1
InChIInChI=1S/C12H23N3O/c1-11(16)15(12-3-4-12)10-9-14-7-5-13(2)6-8-14/h12H,3-10H2,1-2H3
InChIKeyBKYVMTLLOVLEBY-UHFFFAOYSA-N
MW225.34 g/mol
LogP0.24
Rot. Bonds4

About N-cyclopropyl-N-[2-(4-methylpiperazin-1-yl)ethyl]acetamide

N-cyclopropyl-N-[2-(4-methylpiperazin-1-yl)ethyl]acetamide (PubChem CID 163456508) has the molecular formula C12H23N3O and a molecular weight of 225.34 g/mol. Its IUPAC name is N-cyclopropyl-N-[2-(4-methylpiperazin-1-yl)ethyl]acetamide.

Molecular Properties

Compound NameN-cyclopropyl-N-[2-(4-methylpiperazin-1-yl)ethyl]acetamide
PubChem CID163456508
Molecular FormulaC12H23N3O
Molecular Weight225.34 g/mol
Exact Mass225.18
IUPAC NameN-cyclopropyl-N-[2-(4-methylpiperazin-1-yl)ethyl]acetamide
SMILESCC(=O)N(CCN1CCN(C)CC1)C1CC1
InChIInChI=1S/C12H23N3O/c1-11(16)15(12-3-4-12)10-9-14-7-5-13(2)6-8-14/h12H,3-10H2,1-2H3
InChIKeyBKYVMTLLOVLEBY-UHFFFAOYSA-N
XLogP0.24
TPSA26.79 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.34
LogP ≤ 50.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-acetyl-N-[2-(4-methylpiperazin-1-yl)ethyl]acetamide;butane;ethane
CID 178103648
2-[2-(4,7-dimethyl-1,4,7-triazonan-1-yl)ethyl-methylamino]acetic acid
CID 178078829
3-[acetyl(cyclopropyl)amino]propanoic acid
CID 60843836
ethane;1-[4-[2-(4-methylpiperazin-1-yl)ethyl]piperazin-1-yl]ethanone
CID 178104636
N,2-dimethyl-N-[2-(4-methylpiperazin-1-yl)ethyl]propanamide
CID 146274345
N,N-dimethyl-2-(4-methylpiperazin-1-yl)ethanamine;ethane
CID 143417406
N-[4-(4-methylpiperazin-1-yl)butyl]acetamide
CID 110459248
1-[2-(4-methylpiperazin-1-yl)ethyl]piperidine-4-carboxamide
CID 139907414
1,4,7-trimethyl-10-[2-(4,7,10-trimethyl-1,4,7,10-tetrazacyclododec-1-yl)ethyl]-1,4,7,10-tetrazacyclododecane
CID 21130153
N-(1,1-dioxothiolan-3-yl)-N-(3-morpholin-4-ylpropyl)acetamide
CID 23968630
N-[2-(4-methylpiperazin-1-yl)ethyl]-N-(piperidin-4-ylmethyl)cyclopropanamine
CID 82892706
N-methyl-N-[2-(4-methylpiperazin-1-yl)ethyl]azetidin-3-amine
CID 82892705

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-N-[2-(4-methylpiperazin-1-yl)ethyl]acetamide?
The IUPAC name of N-cyclopropyl-N-[2-(4-methylpiperazin-1-yl)ethyl]acetamide (CID 163456508) is N-cyclopropyl-N-[2-(4-methylpiperazin-1-yl)ethyl]acetamide.
What is the SMILES notation for N-cyclopropyl-N-[2-(4-methylpiperazin-1-yl)ethyl]acetamide?
The canonical SMILES for N-cyclopropyl-N-[2-(4-methylpiperazin-1-yl)ethyl]acetamide is CC(=O)N(CCN1CCN(C)CC1)C1CC1.
What is the InChIKey of N-cyclopropyl-N-[2-(4-methylpiperazin-1-yl)ethyl]acetamide?
The InChIKey is BKYVMTLLOVLEBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N3O/c1-11(16)15(12-3-4-12)10-9-14-7-5-13(2)6-8-14/h12H,3-10H2,1-2H3.
What are the key properties of N-cyclopropyl-N-[2-(4-methylpiperazin-1-yl)ethyl]acetamide?
N-cyclopropyl-N-[2-(4-methylpiperazin-1-yl)ethyl]acetamide has a molecular weight of 225.34 g/mol, XLogP of 0.24, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-N-[2-(4-methylpiperazin-1-yl)ethyl]acetamide is sourced from PubChem (CID 163456508), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).