[4-(ethylamino)piperidin-1-yl]-(3-propan-2-yloxyphenyl)methanone

C17H26N2O2 — CID 62919962

IUPAC[4-(ethylamino)piperidin-1-yl]-(3-propan-2-yloxyphenyl)methanone
SMILESCCNC1CCN(C(=O)c2cccc(OC(C)C)c2)CC1
InChIInChI=1S/C17H26N2O2/c1-4-18-15-8-10-19(11-9-15)17(20)14-6-5-7-16(12-14)21-13(2)3/h5-7,12-13,15,18H,4,8-11H2,1-3H3
InChIKeyCRCNHEPBGUIKTM-UHFFFAOYSA-N
MW290.41 g/mol
LogP2.69
Rot. Bonds5

About [4-(ethylamino)piperidin-1-yl]-(3-propan-2-yloxyphenyl)methanone

[4-(ethylamino)piperidin-1-yl]-(3-propan-2-yloxyphenyl)methanone (PubChem CID 62919962) has the molecular formula C17H26N2O2 and a molecular weight of 290.41 g/mol. Its IUPAC name is [4-(ethylamino)piperidin-1-yl]-(3-propan-2-yloxyphenyl)methanone.

Molecular Properties

Compound Name[4-(ethylamino)piperidin-1-yl]-(3-propan-2-yloxyphenyl)methanone
PubChem CID62919962
Molecular FormulaC17H26N2O2
Molecular Weight290.41 g/mol
Exact Mass290.20
IUPAC Name[4-(ethylamino)piperidin-1-yl]-(3-propan-2-yloxyphenyl)methanone
SMILESCCNC1CCN(C(=O)c2cccc(OC(C)C)c2)CC1
InChIInChI=1S/C17H26N2O2/c1-4-18-15-8-10-19(11-9-15)17(20)14-6-5-7-16(12-14)21-13(2)3/h5-7,12-13,15,18H,4,8-11H2,1-3H3
InChIKeyCRCNHEPBGUIKTM-UHFFFAOYSA-N
XLogP2.69
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(4-methylpiperidin-1-yl)-(3-propan-2-yloxyphenyl)methanone
CID 8779088
[4-(chloromethyl)piperidin-1-yl]-(3-propan-2-yloxyphenyl)methanone
CID 63397763
piperidin-1-yl-(3-propan-2-yloxyphenyl)methanone
CID 6458312
[4-(ethylamino)piperidin-1-yl]-(3-methylsulfonylphenyl)methanone
CID 60819092
[4-(cyclopropylmethylamino)piperidin-1-yl]-[3-(difluoromethoxy)phenyl]methanone;hydrochloride
CID 119622263
[3-(aminomethyl)pyrrolidin-1-yl]-(3-propan-2-yloxyphenyl)methanone
CID 62918972
(4-hydroxy-4-methylpiperidin-1-yl)-(3-propan-2-yloxyphenyl)methanone
CID 81103143
(3-bromo-5-propan-2-yloxyphenyl)-[4-(cyclopropylmethylamino)piperidin-1-yl]methanone;hydrochloride
CID 119623046
[4-(1-bromoethyl)piperidin-1-yl]-[3-(difluoromethoxy)phenyl]methanone
CID 106839146
[4-(1-chloroethyl)piperidin-1-yl]-(3-methoxyphenyl)methanone
CID 106838977
[4-(1-aminoethyl)piperidin-1-yl]-[3-(2-methylpropoxy)phenyl]methanone
CID 119518490
3-propan-2-yloxy-N-(1-propylpiperidin-4-yl)benzamide
CID 17249842

Frequently Asked Questions

What is the IUPAC name of [4-(ethylamino)piperidin-1-yl]-(3-propan-2-yloxyphenyl)methanone?
The IUPAC name of [4-(ethylamino)piperidin-1-yl]-(3-propan-2-yloxyphenyl)methanone (CID 62919962) is [4-(ethylamino)piperidin-1-yl]-(3-propan-2-yloxyphenyl)methanone.
What is the SMILES notation for [4-(ethylamino)piperidin-1-yl]-(3-propan-2-yloxyphenyl)methanone?
The canonical SMILES for [4-(ethylamino)piperidin-1-yl]-(3-propan-2-yloxyphenyl)methanone is CCNC1CCN(C(=O)c2cccc(OC(C)C)c2)CC1.
What is the InChIKey of [4-(ethylamino)piperidin-1-yl]-(3-propan-2-yloxyphenyl)methanone?
The InChIKey is CRCNHEPBGUIKTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O2/c1-4-18-15-8-10-19(11-9-15)17(20)14-6-5-7-16(12-14)21-13(2)3/h5-7,12-13,15,18H,4,8-11H2,1-3H3.
What are the key properties of [4-(ethylamino)piperidin-1-yl]-(3-propan-2-yloxyphenyl)methanone?
[4-(ethylamino)piperidin-1-yl]-(3-propan-2-yloxyphenyl)methanone has a molecular weight of 290.41 g/mol, XLogP of 2.69, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(ethylamino)piperidin-1-yl]-(3-propan-2-yloxyphenyl)methanone is sourced from PubChem (CID 62919962), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).