(2S)-N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]-2-(6-methoxynaphthalen-2-yl)propanamide

C25H30N2O3 — CID 18161398

IUPAC(2S)-N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]-2-(6-methoxynaphthalen-2-yl)propanamide
SMILESCOc1ccc2cc([C@H](C)C(=O)NCC(c3ccco3)N3CCCCC3)ccc2c1
InChIInChI=1S/C25H30N2O3/c1-18(19-8-9-21-16-22(29-2)11-10-20(21)15-19)25(28)26-17-23(24-7-6-14-30-24)27-12-4-3-5-13-27/h6-11,14-16,18,23H,3-5,12-13,17H2,1-2H3,(H,26,28)/t18-,23?/m0/s1
InChIKeyMOMDIZCQQBQPSF-XNUZUHMRSA-N
MW406.53 g/mol
LogP4.89
Rot. Bonds7

About (2S)-N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]-2-(6-methoxynaphthalen-2-yl)propanamide

(2S)-N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]-2-(6-methoxynaphthalen-2-yl)propanamide (PubChem CID 18161398) has the molecular formula C25H30N2O3 and a molecular weight of 406.53 g/mol. Its IUPAC name is (2S)-N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]-2-(6-methoxynaphthalen-2-yl)propanamide.

Molecular Properties

Compound Name(2S)-N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]-2-(6-methoxynaphthalen-2-yl)propanamide
PubChem CID18161398
Molecular FormulaC25H30N2O3
Molecular Weight406.53 g/mol
Exact Mass406.23
IUPAC Name(2S)-N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]-2-(6-methoxynaphthalen-2-yl)propanamide
SMILESCOc1ccc2cc([C@H](C)C(=O)NCC(c3ccco3)N3CCCCC3)ccc2c1
InChIInChI=1S/C25H30N2O3/c1-18(19-8-9-21-16-22(29-2)11-10-20(21)15-19)25(28)26-17-23(24-7-6-14-30-24)27-12-4-3-5-13-27/h6-11,14-16,18,23H,3-5,12-13,17H2,1-2H3,(H,26,28)/t18-,23?/m0/s1
InChIKeyMOMDIZCQQBQPSF-XNUZUHMRSA-N
XLogP4.89
TPSA54.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500406.53
LogP ≤ 54.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(azepan-1-yl)-2-(furan-2-yl)ethyl]-3-methoxybenzamide
CID 112503347
(E)-N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]-3-(3-methoxyphenyl)prop-2-enamide
CID 51162669
N-[2-(furan-2-yl)-2-[4-(4-methoxyphenyl)piperazin-1-yl]ethyl]-2-methylpropanamide
CID 16810000
N-[(2S)-2-(furan-2-yl)-2-[4-(4-methoxyphenyl)piperazin-1-yl]ethyl]-2-methylpropanamide
CID 7163085
(2S)-N-(2-hydroxypropyl)-2-(6-methoxynaphthalen-2-yl)propanamide
CID 110901591
N-[(2S)-2-(furan-2-yl)-2-piperidin-1-ylethyl]-2-(6-methoxy-1-benzofuran-3-yl)acetamide
CID 9399035
N-[2-(furan-2-yl)-2-hydroxyethyl]-2-(4-methoxyphenyl)propanamide
CID 111108626
N-[2-(4-methoxyphenyl)-2-pyrrolidin-1-ylethyl]furan-2-carboxamide;hydrochloride
CID 52984979
N-[(2R)-2-(furan-2-yl)-2-[4-(4-methoxyphenyl)piperazin-1-yl]ethyl]-N'-propan-2-yloxamide
CID 7163067
2-amino-N-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]-3-methoxypropanamide
CID 81088845
N-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]-1-(4-methoxyphenyl)-5-oxopyrrolidine-3-carboxamide
CID 55573087
N-[(2R)-2-(furan-2-yl)-2-piperidin-1-ylethyl]-4-propan-2-yloxybenzamide
CID 26834301

Frequently Asked Questions

What is the IUPAC name of (2S)-N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]-2-(6-methoxynaphthalen-2-yl)propanamide?
The IUPAC name of (2S)-N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]-2-(6-methoxynaphthalen-2-yl)propanamide (CID 18161398) is (2S)-N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]-2-(6-methoxynaphthalen-2-yl)propanamide.
What is the SMILES notation for (2S)-N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]-2-(6-methoxynaphthalen-2-yl)propanamide?
The canonical SMILES for (2S)-N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]-2-(6-methoxynaphthalen-2-yl)propanamide is COc1ccc2cc([C@H](C)C(=O)NCC(c3ccco3)N3CCCCC3)ccc2c1.
What is the InChIKey of (2S)-N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]-2-(6-methoxynaphthalen-2-yl)propanamide?
The InChIKey is MOMDIZCQQBQPSF-XNUZUHMRSA-N. The full InChI is InChI=1S/C25H30N2O3/c1-18(19-8-9-21-16-22(29-2)11-10-20(21)15-19)25(28)26-17-23(24-7-6-14-30-24)27-12-4-3-5-13-27/h6-11,14-16,18,23H,3-5,12-13,17H2,1-2H3,(H,26,28)/t18-,23?/m0/s1.
What are the key properties of (2S)-N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]-2-(6-methoxynaphthalen-2-yl)propanamide?
(2S)-N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]-2-(6-methoxynaphthalen-2-yl)propanamide has a molecular weight of 406.53 g/mol, XLogP of 4.89, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]-2-(6-methoxynaphthalen-2-yl)propanamide is sourced from PubChem (CID 18161398), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).