cyclopropyl-[4-(ethylaminomethyl)piperidin-1-yl]methanone

C12H22N2O — CID 80552531

IUPACcyclopropyl-[4-(ethylaminomethyl)piperidin-1-yl]methanone
SMILESCCNCC1CCN(C(=O)C2CC2)CC1
InChIInChI=1S/C12H22N2O/c1-2-13-9-10-5-7-14(8-6-10)12(15)11-3-4-11/h10-11,13H,2-9H2,1H3
InChIKeyPALAULZRZZYOQS-UHFFFAOYSA-N
MW210.32 g/mol
LogP1.24
Rot. Bonds4

About cyclopropyl-[4-(ethylaminomethyl)piperidin-1-yl]methanone

cyclopropyl-[4-(ethylaminomethyl)piperidin-1-yl]methanone (PubChem CID 80552531) has the molecular formula C12H22N2O and a molecular weight of 210.32 g/mol. Its IUPAC name is cyclopropyl-[4-(ethylaminomethyl)piperidin-1-yl]methanone.

Molecular Properties

Compound Namecyclopropyl-[4-(ethylaminomethyl)piperidin-1-yl]methanone
PubChem CID80552531
Molecular FormulaC12H22N2O
Molecular Weight210.32 g/mol
Exact Mass210.17
IUPAC Namecyclopropyl-[4-(ethylaminomethyl)piperidin-1-yl]methanone
SMILESCCNCC1CCN(C(=O)C2CC2)CC1
InChIInChI=1S/C12H22N2O/c1-2-13-9-10-5-7-14(8-6-10)12(15)11-3-4-11/h10-11,13H,2-9H2,1H3
InChIKeyPALAULZRZZYOQS-UHFFFAOYSA-N
XLogP1.24
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.32
LogP ≤ 51.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

cyclopropyl-[4-(methylaminomethyl)piperidin-1-yl]methanone;hydrochloride
CID 169490468
[4-(ethylaminomethyl)piperidin-1-yl]-(2-methylcyclopropyl)methanone
CID 80552587
4-[4-(ethylaminomethyl)piperidine-1-carbonyl]pyrrolidin-2-one
CID 81485174
[4-[(tert-butylamino)methyl]piperidin-1-yl]-cyclopropylmethanone
CID 134166280
4-[4-(ethylaminomethyl)piperidine-1-carbonyl]-1-pentan-2-ylpyrrolidin-2-one
CID 119646804
1-[4-(ethylaminomethyl)piperidin-1-yl]-3,3,3-trifluoro-2-(trifluoromethyl)propan-1-one
CID 103310424
cyclopropyl-[4-(cyclopropylmethylamino)piperidin-1-yl]methanone
CID 43747911
4-(ethylaminomethyl)-N-propylpiperidine-1-carboxamide
CID 80552356
tert-butyl 4-(ethylaminomethyl)piperidine-1-carboxylate
CID 53249196
1-[4-(ethylaminomethyl)piperidin-1-yl]-2-methoxyethanone;hydrochloride
CID 119645863
1-[2-[4-(ethylaminomethyl)piperidine-1-carbonyl]pyrrolidin-1-yl]ethanone;hydrochloride
CID 119644088
ethane;1-[3-(ethylaminomethyl)pyrrolidin-1-yl]ethanone
CID 143082377

Frequently Asked Questions

What is the IUPAC name of cyclopropyl-[4-(ethylaminomethyl)piperidin-1-yl]methanone?
The IUPAC name of cyclopropyl-[4-(ethylaminomethyl)piperidin-1-yl]methanone (CID 80552531) is cyclopropyl-[4-(ethylaminomethyl)piperidin-1-yl]methanone.
What is the SMILES notation for cyclopropyl-[4-(ethylaminomethyl)piperidin-1-yl]methanone?
The canonical SMILES for cyclopropyl-[4-(ethylaminomethyl)piperidin-1-yl]methanone is CCNCC1CCN(C(=O)C2CC2)CC1.
What is the InChIKey of cyclopropyl-[4-(ethylaminomethyl)piperidin-1-yl]methanone?
The InChIKey is PALAULZRZZYOQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2O/c1-2-13-9-10-5-7-14(8-6-10)12(15)11-3-4-11/h10-11,13H,2-9H2,1H3.
What are the key properties of cyclopropyl-[4-(ethylaminomethyl)piperidin-1-yl]methanone?
cyclopropyl-[4-(ethylaminomethyl)piperidin-1-yl]methanone has a molecular weight of 210.32 g/mol, XLogP of 1.24, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopropyl-[4-(ethylaminomethyl)piperidin-1-yl]methanone is sourced from PubChem (CID 80552531), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).