N-(cyclopropylmethyl)propanamide;(2E,3Z)-2-ethylidene-3-prop-2-enylideneoxolane

C16H25NO2 — CID 142413028

IUPACN-(cyclopropylmethyl)propanamide;(2E,3Z)-2-ethylidene-3-prop-2-enylideneoxolane
SMILESC=C/C=C1/CCO/C1=C/C.CCC(=O)NCC1CC1
InChIInChI=1S/C9H12O.C7H13NO/c1-3-5-8-6-7-10-9(8)4-2;1-2-7(9)8-5-6-3-4-6/h3-5H,1,6-7H2,2H3;6H,2-5H2,1H3,(H,8,9)/b8-5-,9-4+;
InChIKeyWKGZXBVVNFEBGQ-HHHUAFAMSA-N
MW263.38 g/mol
LogP3.35
Rot. Bonds4

About N-(cyclopropylmethyl)propanamide;(2E,3Z)-2-ethylidene-3-prop-2-enylideneoxolane

N-(cyclopropylmethyl)propanamide;(2E,3Z)-2-ethylidene-3-prop-2-enylideneoxolane (PubChem CID 142413028) has the molecular formula C16H25NO2 and a molecular weight of 263.38 g/mol. Its IUPAC name is N-(cyclopropylmethyl)propanamide;(2E,3Z)-2-ethylidene-3-prop-2-enylideneoxolane.

Molecular Properties

Compound NameN-(cyclopropylmethyl)propanamide;(2E,3Z)-2-ethylidene-3-prop-2-enylideneoxolane
PubChem CID142413028
Molecular FormulaC16H25NO2
Molecular Weight263.38 g/mol
Exact Mass263.19
IUPAC NameN-(cyclopropylmethyl)propanamide;(2E,3Z)-2-ethylidene-3-prop-2-enylideneoxolane
SMILESC=C/C=C1/CCO/C1=C/C.CCC(=O)NCC1CC1
InChIInChI=1S/C9H12O.C7H13NO/c1-3-5-8-6-7-10-9(8)4-2;1-2-7(9)8-5-6-3-4-6/h3-5H,1,6-7H2,2H3;6H,2-5H2,1H3,(H,8,9)/b8-5-,9-4+;
InChIKeyWKGZXBVVNFEBGQ-HHHUAFAMSA-N
XLogP3.35
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 53.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(Z)-N-(2-aminoethyl)-4-(4-ethenyl-2,3-dihydrofuran-5-yl)but-3-enamide
CID 68304533
N-(cyclopropylmethyl)-4-methoxycyclohexa-2,4-diene-1-carboxamide
CID 70904221
N-[(4Z,6E)-7-butoxy-8-methoxy-3-methylideneocta-4,6-dienyl]acetamide
CID 117906275
N-[2-[2-(2-ethylideneoxolan-3-ylidene)-3-methylidenecyclopentyl]ethyl]propanamide
CID 123797094
ethane;(4Z,6E)-N-ethyl-6-(propan-2-yloxymethyl)nona-4,6-dienamide
CID 142894613
ethane;(3Z,6E)-6-(methoxymethyl)-3-methylocta-1,3,6-triene;pyrrolidin-2-one
CID 143093513
2-[(3E,4Z)-2-methoxy-4-(2-methylpropylidene)-3-propylidenecyclohexa-1,5-dien-1-yl]-N-methylacetamide
CID 156465071
N-[2-[(2Z)-2-[(2E)-2-ethylideneoxolan-3-ylidene]-3-methylidenecyclopentyl]ethyl]propanamide
CID 163459212
(4Z,6E)-N-ethyl-6-(propan-2-yloxymethyl)nona-4,6-dienamide
CID 142894614
N-[(3-ethoxycyclohexa-2,4-dien-1-yl)methyl]acetamide
CID 155749588

Frequently Asked Questions

What is the IUPAC name of N-(cyclopropylmethyl)propanamide;(2E,3Z)-2-ethylidene-3-prop-2-enylideneoxolane?
The IUPAC name of N-(cyclopropylmethyl)propanamide;(2E,3Z)-2-ethylidene-3-prop-2-enylideneoxolane (CID 142413028) is N-(cyclopropylmethyl)propanamide;(2E,3Z)-2-ethylidene-3-prop-2-enylideneoxolane.
What is the SMILES notation for N-(cyclopropylmethyl)propanamide;(2E,3Z)-2-ethylidene-3-prop-2-enylideneoxolane?
The canonical SMILES for N-(cyclopropylmethyl)propanamide;(2E,3Z)-2-ethylidene-3-prop-2-enylideneoxolane is C=C/C=C1/CCO/C1=C/C.CCC(=O)NCC1CC1.
What is the InChIKey of N-(cyclopropylmethyl)propanamide;(2E,3Z)-2-ethylidene-3-prop-2-enylideneoxolane?
The InChIKey is WKGZXBVVNFEBGQ-HHHUAFAMSA-N. The full InChI is InChI=1S/C9H12O.C7H13NO/c1-3-5-8-6-7-10-9(8)4-2;1-2-7(9)8-5-6-3-4-6/h3-5H,1,6-7H2,2H3;6H,2-5H2,1H3,(H,8,9)/b8-5-,9-4+;.
What are the key properties of N-(cyclopropylmethyl)propanamide;(2E,3Z)-2-ethylidene-3-prop-2-enylideneoxolane?
N-(cyclopropylmethyl)propanamide;(2E,3Z)-2-ethylidene-3-prop-2-enylideneoxolane has a molecular weight of 263.38 g/mol, XLogP of 3.35, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopropylmethyl)propanamide;(2E,3Z)-2-ethylidene-3-prop-2-enylideneoxolane is sourced from PubChem (CID 142413028), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).