(2-aminocyclopropyl)-(4-methylpiperazin-1-yl)methanone

C9H17N3O — CID 82234715

IUPAC(2-aminocyclopropyl)-(4-methylpiperazin-1-yl)methanone
SMILESCN1CCN(C(=O)C2CC2N)CC1
InChIInChI=1S/C9H17N3O/c1-11-2-4-12(5-3-11)9(13)7-6-8(7)10/h7-8H,2-6,10H2,1H3
InChIKeyTYSIDIVOEUAZHX-UHFFFAOYSA-N
MW183.25 g/mol
LogP-0.89
Rot. Bonds1

About (2-aminocyclopropyl)-(4-methylpiperazin-1-yl)methanone

(2-aminocyclopropyl)-(4-methylpiperazin-1-yl)methanone (PubChem CID 82234715) has the molecular formula C9H17N3O and a molecular weight of 183.25 g/mol. Its IUPAC name is (2-aminocyclopropyl)-(4-methylpiperazin-1-yl)methanone.

Molecular Properties

Compound Name(2-aminocyclopropyl)-(4-methylpiperazin-1-yl)methanone
PubChem CID82234715
Molecular FormulaC9H17N3O
Molecular Weight183.25 g/mol
Exact Mass183.14
IUPAC Name(2-aminocyclopropyl)-(4-methylpiperazin-1-yl)methanone
SMILESCN1CCN(C(=O)C2CC2N)CC1
InChIInChI=1S/C9H17N3O/c1-11-2-4-12(5-3-11)9(13)7-6-8(7)10/h7-8H,2-6,10H2,1H3
InChIKeyTYSIDIVOEUAZHX-UHFFFAOYSA-N
XLogP-0.89
TPSA49.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.25
LogP ≤ 5-0.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze (2-aminocyclopropyl)-(4-methylpiperazin-1-yl)methanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(2-aminocyclopropyl)-(4-methylsulfonylpiperazin-1-yl)methanone
CID 82235812
(2-aminocyclopropyl)-(4-prop-2-ynylpiperazin-1-yl)methanone
CID 82235754
(2-aminocyclopropyl)-[4-[(dimethylamino)methyl]piperidin-1-yl]methanone
CID 82237534
[4-(4-methylpiperazine-1-carbonyl)cyclohexyl]-pyrrolidin-1-ylmethanone
CID 109145589
(4-aminopiperazin-1-yl)-(1-methylpiperidin-4-yl)methanone
CID 174315693
(5-amino-2,4-dimethylcyclohexyl)-(4-tert-butylpiperazin-1-yl)methanone
CID 102706693
[(3R,4R,5R,6R)-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]-(4-methylpiperazin-1-yl)methanone
CID 163919460
(2-aminocyclopropyl)-(2-methylmorpholin-4-yl)methanone
CID 114995835
(2-aminocyclopropyl)-(1,3-dihydroisoindol-2-yl)methanone
CID 114999401
(1-methylazetidin-2-yl)-(4-methylpiperazin-1-yl)methanone
CID 145087552
cyclobutyl-(4-methylpiperazin-1-yl)methanone;ethane
CID 176666855
(1-methyl-4-phenylpyrrolidin-3-yl)-(4-methylpiperazin-1-yl)methanone
CID 166828290

Frequently Asked Questions

What is the IUPAC name of (2-aminocyclopropyl)-(4-methylpiperazin-1-yl)methanone?
The IUPAC name of (2-aminocyclopropyl)-(4-methylpiperazin-1-yl)methanone (CID 82234715) is (2-aminocyclopropyl)-(4-methylpiperazin-1-yl)methanone.
What is the SMILES notation for (2-aminocyclopropyl)-(4-methylpiperazin-1-yl)methanone?
The canonical SMILES for (2-aminocyclopropyl)-(4-methylpiperazin-1-yl)methanone is CN1CCN(C(=O)C2CC2N)CC1.
What is the InChIKey of (2-aminocyclopropyl)-(4-methylpiperazin-1-yl)methanone?
The InChIKey is TYSIDIVOEUAZHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17N3O/c1-11-2-4-12(5-3-11)9(13)7-6-8(7)10/h7-8H,2-6,10H2,1H3.
What are the key properties of (2-aminocyclopropyl)-(4-methylpiperazin-1-yl)methanone?
(2-aminocyclopropyl)-(4-methylpiperazin-1-yl)methanone has a molecular weight of 183.25 g/mol, XLogP of -0.89, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-aminocyclopropyl)-(4-methylpiperazin-1-yl)methanone is sourced from PubChem (CID 82234715), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).