(2S)-2-cyclopropyl-2-ethoxy-N-(4-methoxynaphthalen-1-yl)propanamide

C19H23NO3 — CID 100763642

IUPAC(2S)-2-cyclopropyl-2-ethoxy-N-(4-methoxynaphthalen-1-yl)propanamide
SMILESCCO[C@](C)(C(=O)Nc1ccc(OC)c2ccccc12)C1CC1
InChIInChI=1S/C19H23NO3/c1-4-23-19(2,13-9-10-13)18(21)20-16-11-12-17(22-3)15-8-6-5-7-14(15)16/h5-8,11-13H,4,9-10H2,1-3H3,(H,20,21)/t19-/m0/s1
InChIKeyBLLHNKITBDXTFN-IBGZPJMESA-N
MW313.40 g/mol
LogP3.99
Rot. Bonds6

About (2S)-2-cyclopropyl-2-ethoxy-N-(4-methoxynaphthalen-1-yl)propanamide

(2S)-2-cyclopropyl-2-ethoxy-N-(4-methoxynaphthalen-1-yl)propanamide (PubChem CID 100763642) has the molecular formula C19H23NO3 and a molecular weight of 313.40 g/mol. Its IUPAC name is (2S)-2-cyclopropyl-2-ethoxy-N-(4-methoxynaphthalen-1-yl)propanamide.

Molecular Properties

Compound Name(2S)-2-cyclopropyl-2-ethoxy-N-(4-methoxynaphthalen-1-yl)propanamide
PubChem CID100763642
Molecular FormulaC19H23NO3
Molecular Weight313.40 g/mol
Exact Mass313.17
IUPAC Name(2S)-2-cyclopropyl-2-ethoxy-N-(4-methoxynaphthalen-1-yl)propanamide
SMILESCCO[C@](C)(C(=O)Nc1ccc(OC)c2ccccc12)C1CC1
InChIInChI=1S/C19H23NO3/c1-4-23-19(2,13-9-10-13)18(21)20-16-11-12-17(22-3)15-8-6-5-7-14(15)16/h5-8,11-13H,4,9-10H2,1-3H3,(H,20,21)/t19-/m0/s1
InChIKeyBLLHNKITBDXTFN-IBGZPJMESA-N
XLogP3.99
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.40
LogP ≤ 53.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2R)-N-(4-butoxynaphthalen-1-yl)-2-cyclopropyl-2-ethoxypropanamide
CID 100763689
(2S)-2-cyclopropyl-2-ethoxy-N-(8-methoxyquinolin-5-yl)propanamide
CID 100777479
(2S)-2-ethoxy-N-(4-methoxynaphthalen-1-yl)-2-methylheptanamide
CID 100761479
2-methoxy-N-(4-methoxynaphthalen-1-yl)-2-methylpropanamide
CID 100752361
2-cyclopropyl-2-ethoxy-N-[4-methoxy-3-(trifluoromethyl)phenyl]propanamide
CID 133203979
methyl 5-[[(2R)-2-cyclopropyl-2-ethoxypropanoyl]amino]-2-methoxybenzoate
CID 100763279
(2R)-2-methoxy-N-(4-methoxynaphthalen-1-yl)-2-methylhexanamide
CID 100755111
(2S)-2-cyclopropyl-2-ethoxy-N-(6-ethoxy-2-methyl-3-pyridinyl)propanamide
CID 100777431
(2R)-2-cyclopropyl-N-(8-propan-2-yloxyquinolin-5-yl)-2-propoxypropanamide
CID 100778843
2-cyclopropyl-N-[8-(2-methylpropoxy)quinolin-5-yl]-2-propoxypropanamide
CID 133206007
(2R)-2-ethoxy-N-(8-methoxyquinolin-5-yl)-2-methylbutanamide
CID 100776127
(2R)-2-ethoxy-2-methyl-N-[4-(2-methylpropoxy)naphthalen-1-yl]pentanamide
CID 100760364

Frequently Asked Questions

What is the IUPAC name of (2S)-2-cyclopropyl-2-ethoxy-N-(4-methoxynaphthalen-1-yl)propanamide?
The IUPAC name of (2S)-2-cyclopropyl-2-ethoxy-N-(4-methoxynaphthalen-1-yl)propanamide (CID 100763642) is (2S)-2-cyclopropyl-2-ethoxy-N-(4-methoxynaphthalen-1-yl)propanamide.
What is the SMILES notation for (2S)-2-cyclopropyl-2-ethoxy-N-(4-methoxynaphthalen-1-yl)propanamide?
The canonical SMILES for (2S)-2-cyclopropyl-2-ethoxy-N-(4-methoxynaphthalen-1-yl)propanamide is CCO[C@](C)(C(=O)Nc1ccc(OC)c2ccccc12)C1CC1.
What is the InChIKey of (2S)-2-cyclopropyl-2-ethoxy-N-(4-methoxynaphthalen-1-yl)propanamide?
The InChIKey is BLLHNKITBDXTFN-IBGZPJMESA-N. The full InChI is InChI=1S/C19H23NO3/c1-4-23-19(2,13-9-10-13)18(21)20-16-11-12-17(22-3)15-8-6-5-7-14(15)16/h5-8,11-13H,4,9-10H2,1-3H3,(H,20,21)/t19-/m0/s1.
What are the key properties of (2S)-2-cyclopropyl-2-ethoxy-N-(4-methoxynaphthalen-1-yl)propanamide?
(2S)-2-cyclopropyl-2-ethoxy-N-(4-methoxynaphthalen-1-yl)propanamide has a molecular weight of 313.40 g/mol, XLogP of 3.99, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-cyclopropyl-2-ethoxy-N-(4-methoxynaphthalen-1-yl)propanamide is sourced from PubChem (CID 100763642), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).